data_2lxi_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 2lxi _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 ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 118.367 -0.825 . . . . 75.140000000000001 112.381 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.510000000000005 108.068 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.510000000000005 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 61.149999999999999 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.150000000000006 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.592 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.310000000000002 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 73.340000000000003 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 64.430000000000007 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.240000000000002 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.229999999999997 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.229999999999997 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 64.230000000000004 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 74.230000000000004 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.350000000000001 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.340000000000003 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.319999999999993 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 74.120000000000005 110.122 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 63.409999999999997 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 73.25 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 71.409999999999997 108.424 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.439999999999998 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 63.140000000000001 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 74.209999999999994 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 74.510000000000005 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 55.409999999999997 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.219999999999999 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.239999999999995 108.347 151.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 73.109999999999999 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 71.439999999999998 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 74.230000000000004 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.150000000000006 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.329999999999998 107.172 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 73.409999999999997 114.635 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.439999999999998 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.420000000000002 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.539999999999999 110.169 168.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.310000000000002 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.340000000000003 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.209999999999994 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 74.540000000000006 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.530000000000001 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.349999999999994 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.519999999999996 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 75.120000000000005 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 74.25 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 74.239999999999995 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.430000000000007 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 72.329999999999998 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 72.25 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 73.310000000000002 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 72.519999999999996 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 73.340000000000003 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.420000000000002 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 63.140000000000001 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 65.120000000000005 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.230000000000004 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 71.430000000000007 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.140000000000001 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 72.540000000000006 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 72.310000000000002 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.310000000000002 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.540000000000006 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 64.230000000000004 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.129999999999995 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.120000000000005 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.592 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.129999999999995 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.439999999999998 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.039999999999999 114.711 -175.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 114.686 1.365 . . . . 73.109999999999999 114.686 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 74.430000000000007 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.420000000000002 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.519999999999996 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.400000000000006 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.230000000000004 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 74.400000000000006 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.240000000000002 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.310000000000002 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.099999999999994 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.400000000000006 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.409999999999997 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 73.129999999999995 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.519999999999996 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.530000000000001 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.430000000000007 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.540000000000006 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 70.140000000000001 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.109999999999999 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 74.299999999999997 109.054 -177.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.400000000000006 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 73.5 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.439999999999998 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 62.219999999999999 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.400000000000006 109.066 -171.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 73.409999999999997 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 71.319999999999993 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 74.319999999999993 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.420000000000002 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.5 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 73.209999999999994 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tm? . . . . . 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 74.319999999999993 110.258 178.809 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.109999999999999 114.876 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.340000000000003 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.099999999999994 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.120000000000005 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.209999999999994 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 65.209999999999994 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.319999999999993 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 74.409999999999997 109.59 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.230000000000004 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 74.439999999999998 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.430000000000007 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.439999999999998 112.286 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 74.540000000000006 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 71.319999999999993 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 74.519999999999996 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 72.409999999999997 112.885 -176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.200000000000003 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.200000000000003 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.439999999999998 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.200000000000003 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 72.510000000000005 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.140000000000001 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.400000000000006 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.530000000000001 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 72.230000000000004 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.519999999999996 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.429 ' C ' ' H ' ' A' ' 72' ' ' GLY . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.420000000000002 106.774 -168.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 74.439999999999998 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.429 ' H ' ' C ' ' A' ' 70' ' ' ILE . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.439999999999998 112.131 -174.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.239999999999995 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 74.420000000000002 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 72.219999999999999 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.329999999999998 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.510000000000005 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.420000000000002 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.310000000000002 111.85 175.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.120000000000005 109.547 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.063 -0.97 . . . . 61.149999999999999 111.332 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.420000000000002 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 71.450000000000003 105.923 161.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 75.420000000000002 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.409999999999997 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.540000000000006 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 75.439999999999998 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 75.319999999999993 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.010000000000005 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.039999999999999 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 71.340000000000003 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.319999999999993 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.420000000000002 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.140000000000001 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.200000000000003 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 75.299999999999997 110.779 -172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.400000000000006 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.230000000000004 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.209999999999994 108.823 176.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.340000000000003 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.430000000000007 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.009999999999998 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.299999999999997 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.329999999999998 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 75.439999999999998 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.420000000000002 114.06 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 75.409999999999997 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.350000000000001 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.310000000000002 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.319999999999993 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.209999999999994 106.736 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.377 0.51 . . . . 74.519999999999996 112.377 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 60.109999999999999 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.310000000000002 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.340000000000003 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 73.420000000000002 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.519999999999996 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 73.530000000000001 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.239999999999995 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 75.340000000000003 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 73.430000000000007 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.549999999999997 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.129999999999995 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.120000000000005 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 75.530000000000001 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.209999999999994 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.41 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.310000000000002 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.230000000000004 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 74.120000000000005 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 74.420000000000002 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 75.409999999999997 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 75.200000000000003 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.319999999999993 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.219999999999999 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 74.219999999999999 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 75.319999999999993 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.200000000000003 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.019999999999996 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.439999999999998 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 73.439999999999998 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.109999999999999 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.219999999999999 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 74.409999999999997 109.961 171.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.200000000000003 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.219999999999999 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 112.568 0.581 . . . . 72.120000000000005 112.568 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.219999999999999 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.299999999999997 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.299999999999997 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.229999999999997 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.219999999999999 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.229999999999997 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 74.109999999999999 109.308 163.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.209999999999994 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.409999999999997 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.340000000000003 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.400000000000006 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.129999999999995 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.439999999999998 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.319999999999993 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.130000000000003 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.219999999999999 109.266 -174.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.340000000000003 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.329999999999998 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.129999999999995 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 74.319999999999993 108.332 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.439999999999998 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.439999999999998 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.448 ' CD2' HD22 ' A' ' 64' ' ' ASN . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.239999999999995 112.547 175.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 74.200000000000003 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 74.340000000000003 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.109999999999999 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 74.400000000000006 108.672 157.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.540000000000006 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 70.219999999999999 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 73.239999999999995 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.530000000000001 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.200000000000003 108.608 165.22 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 118.393 -0.813 . . . . 74.430000000000007 112.947 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.020000000000003 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.519999999999996 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.420000000000002 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.209999999999994 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 72.120000000000005 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.540000000000006 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 73.099999999999994 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 71.530000000000001 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.540000000000006 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 74.200000000000003 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.520000000000003 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.519999999999996 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 62.329999999999998 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 74.140000000000001 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 73.430000000000007 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.209999999999994 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 74.420000000000002 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 72.299999999999997 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.448 HD22 ' CD2' ' A' ' 25' ' ' HIS . 64.0 m-80 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 73.200000000000003 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.310000000000002 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.299999999999997 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.140000000000001 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 74.0 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.319999999999993 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.120000000000005 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 63.130000000000003 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.420000000000002 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.319999999999993 106.599 170.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.329999999999998 108.244 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.519999999999996 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.219999999999999 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.239999999999995 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.530000000000001 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.420000000000002 108.814 160.659 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.223 -0.314 0 CA-C-O 122.578 1.18 . . . . 73.329999999999998 109.912 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.310000000000002 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.209999999999994 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.340000000000003 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.340000000000003 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.140000000000001 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.019999999999996 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 74.030000000000001 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.150000000000006 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.230000000000004 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.430000000000007 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 73.030000000000001 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.010000000000005 111.845 -176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.349999999999994 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 71.129999999999995 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.009999999999998 109.286 172.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.450000000000003 109.191 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.349999999999994 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.439999999999998 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.349999999999994 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.420000000000002 110.923 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.409999999999997 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.329999999999998 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.416 ' CE1' HD22 ' A' ' 64' ' ' ASN . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.230000000000004 111.687 163.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.010000000000005 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.409999999999997 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.439999999999998 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.230000000000004 114.317 -170.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.140000000000001 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.439999999999998 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 73.530000000000001 111.674 -167.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 73.019999999999996 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.219999999999999 109.986 172.369 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 72.049999999999997 114.928 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.420000000000002 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.430000000000007 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 62.409999999999997 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 72.329999999999998 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.439999999999998 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.200000000000003 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.099999999999994 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.540000000000006 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.329999999999998 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 73.120000000000005 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 72.140000000000001 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.109999999999999 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 71.430000000000007 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.209999999999994 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.140000000000001 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.129999999999995 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.439999999999998 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 71.340000000000003 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.409999999999997 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.416 HD22 ' CE1' ' A' ' 25' ' ' HIS . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 74.319999999999993 113.073 168.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 52.329999999999998 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.400000000000006 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 74.230000000000004 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 73.209999999999994 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 74.010000000000005 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 72.450000000000003 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.430000000000007 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 74.129999999999995 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.319999999999993 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.140000000000001 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 74.120000000000005 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.310000000000002 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.129999999999995 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.019999999999996 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.200000000000003 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.200000000000003 107.064 173.198 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 120.48 0.181 . . . . 73.340000000000003 110.624 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 73.549999999999997 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.450000000000003 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 65.120000000000005 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.310000000000002 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.452 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.420000000000002 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.150000000000006 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.140000000000001 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.120000000000005 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 64.310000000000002 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.120000000000005 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 74.209999999999994 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.510000000000005 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 75.25 109.719 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.439999999999998 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.340000000000003 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 72.140000000000001 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 73.219999999999999 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 71.349999999999994 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 74.230000000000004 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 71.310000000000002 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 64.349999999999994 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.319999999999993 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.549999999999997 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.020000000000003 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.519999999999996 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 73.25 107.224 167.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 70.349999999999994 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 75.150000000000006 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.420000000000002 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 73.450000000000003 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.030000000000001 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 75.120000000000005 108.766 164.942 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 74.319999999999993 110.958 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.329999999999998 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 71.530000000000001 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 74.540000000000006 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.549999999999997 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.407 HG12 ' CE1' ' A' ' 51' ' ' PHE . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.420000000000002 105.693 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.239999999999995 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.407 ' CE1' HG12 ' A' ' 49' ' ' VAL . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.409999999999997 111.813 -164.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.140000000000001 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.049999999999997 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 72.450000000000003 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.310000000000002 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.209999999999994 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.520000000000003 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 73.109999999999999 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.540000000000006 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 74.239999999999995 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.407 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 62.549999999999997 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.150000000000006 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.039999999999999 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.349999999999994 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 74.120000000000005 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.519999999999996 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 74.109999999999999 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 71.150000000000006 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.420000000000002 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 74.420000000000002 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.230000000000004 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.210000000000001 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.109999999999999 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 63.240000000000002 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 72.510000000000005 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.407 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.409999999999997 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.452 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 71.239999999999995 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 74.349999999999994 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 73.340000000000003 108.767 171.54 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 118.218 -0.896 . . . . 71.120000000000005 113.275 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 73.109999999999999 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 74.430000000000007 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.310000000000002 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.340000000000003 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 74.340000000000003 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.430000000000007 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.319999999999993 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.340000000000003 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.129999999999995 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 72.420000000000002 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 72.340000000000003 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.109999999999999 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 73.329999999999998 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.299999999999997 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.310000000000002 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 73.319999999999993 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.519999999999996 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 73.219999999999999 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.400000000000006 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 75.099999999999994 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.400000000000006 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.510000000000005 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.514 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 52.409999999999997 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.340000000000003 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.319999999999993 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.239999999999995 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.319999999999993 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.150000000000006 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.340000000000003 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.409999999999997 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 74.530000000000001 107.986 173.642 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.340000000000003 115.296 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 71.010000000000005 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.230000000000004 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.420000000000002 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 73.400000000000006 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.430000000000007 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.430000000000007 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 75.430000000000007 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.299999999999997 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 74.219999999999999 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.409999999999997 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 75.299999999999997 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.510000000000005 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.200000000000003 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.319999999999993 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 75.540000000000006 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.219999999999999 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 70.340000000000003 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.299999999999997 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.019999999999996 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.099999999999994 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.040000000000006 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 m170 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.340000000000003 114.908 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 72.209999999999994 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 74.209999999999994 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.209999999999994 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 74.129999999999995 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 73.140000000000001 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.430000000000007 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.040000000000006 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.200000000000003 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.420000000000002 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 72.400000000000006 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.200000000000003 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.329999999999998 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.219999999999999 108.148 173.662 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 119.422 -0.323 . . . . 74.25 111.271 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 73.340000000000003 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 65.540000000000006 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.540000000000006 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 72.010000000000005 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 73.340000000000003 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 73.430000000000007 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 74.219999999999999 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.510000000000005 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.209999999999994 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.420000000000002 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 73.549999999999997 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.423 ' H ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.450000000000003 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.319999999999993 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.040000000000006 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 72.040000000000006 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.120000000000005 113.122 -169.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 43.119999999999997 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.239999999999995 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.492 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.209999999999994 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 71.209999999999994 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.019999999999996 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.510000000000005 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 70.140000000000001 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.010000000000005 109.439 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.040000000000006 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 63.240000000000002 112.137 -146.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.239999999999995 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.010000000000005 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 74.439999999999998 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.209999999999994 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.423 HD23 ' H ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.120000000000005 111.624 173.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.426 1.269 . . . . 75.099999999999994 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.219999999999999 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.219999999999999 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 64.099999999999994 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 75.420000000000002 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.340000000000003 107.464 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.409999999999997 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 74.319999999999993 109.604 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.239999999999995 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.439999999999998 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.25 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.340000000000003 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 73.439999999999998 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.420000000000002 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.340000000000003 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . 0.492 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 71.329999999999998 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.349999999999994 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.209999999999994 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 73.409999999999997 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.450000000000003 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.109999999999999 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 72.349999999999994 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 65.25 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 61.240000000000002 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.349999999999994 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 55.240000000000002 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 63.109999999999999 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.540000000000006 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 75.349999999999994 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 75.140000000000001 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.329999999999998 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 64.310000000000002 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.239999999999995 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.420000000000002 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.140000000000001 112.752 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 118.515 -0.755 . . . . 74.129999999999995 112.51 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.319999999999993 105.884 -176.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 74.420000000000002 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.340000000000003 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.409999999999997 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.120000000000005 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.299999999999997 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.010000000000005 111.236 -175.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.430000000000007 112.406 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 75.450000000000003 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.519999999999996 114.188 -170.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 73.140000000000001 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 75.340000000000003 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.200000000000003 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 73.540000000000006 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.540000000000006 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 75.219999999999999 109.416 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 75.530000000000001 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.32 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.519999999999996 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.109999999999999 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.319999999999993 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.219999999999999 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.340000000000003 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 63.520000000000003 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 74.200000000000003 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.530000000000001 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.099999999999994 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.299999999999997 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.439999999999998 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 74.430000000000007 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.049999999999997 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tm? . . . . . 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.299999999999997 109.638 174.252 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 115.026 1.491 . . . . 73.219999999999999 115.026 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.120000000000005 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.420000000000002 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.409999999999997 109.247 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 73.239999999999995 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 73.400000000000006 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 73.010000000000005 113.14 164.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.230000000000004 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.340000000000003 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.209999999999994 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 73.120000000000005 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 70.019999999999996 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.340000000000003 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.200000000000003 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.310000000000002 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.319999999999993 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.109999999999999 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.230000000000004 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.229999999999997 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.230000000000004 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 61.439999999999998 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.340000000000003 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 72.409999999999997 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.540000000000006 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.439999999999998 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.340000000000003 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.299999999999997 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.299999999999997 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 63.210000000000001 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.420000000000002 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.099999999999994 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 72.310000000000002 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.409999999999997 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.439999999999998 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.420000000000002 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.340000000000003 108.469 158.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 119.214 -0.422 . . . . 74.310000000000002 112.001 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.519999999999996 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 75.239999999999995 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.400000000000006 109.861 166.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.120000000000005 108.548 -168.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 73.430000000000007 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.530000000000001 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.409999999999997 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.319999999999993 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 75.409999999999997 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 75.349999999999994 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.209999999999994 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.140000000000001 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.140000000000001 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.209999999999994 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 71.409999999999997 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.420000000000002 110.126 173.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.409999999999997 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 71.140000000000001 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.530000000000001 108.26 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 61.229999999999997 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 72.109999999999999 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.519999999999996 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.239999999999995 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.41 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 74.420000000000002 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.319999999999993 115.227 -165.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.409999999999997 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.400000000000006 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.109999999999999 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.209999999999994 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.420000000000002 113.333 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 108.242 -1.022 . . . . 71.120000000000005 108.242 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.319999999999993 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 72.200000000000003 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.420000000000002 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.120000000000005 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.540000000000006 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.319999999999993 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.430000000000007 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 73.140000000000001 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.510000000000005 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 73.319999999999993 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 74.200000000000003 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 71.430000000000007 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 74.200000000000003 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 72.400000000000006 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 75.329999999999998 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.150000000000006 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.310000000000002 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.129999999999995 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.209999999999994 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.319999999999993 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 73.540000000000006 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 74.439999999999998 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.319999999999993 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 73.549999999999997 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.439999999999998 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.129999999999995 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.319999999999993 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.549999999999997 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.549999999999997 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.409999999999997 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.150000000000006 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.549999999999997 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.539999999999999 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 73.140000000000001 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 74.5 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.219999999999999 106.984 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 108.636 -0.875 . . . . 74.549999999999997 108.636 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 75.549999999999997 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 75.340000000000003 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.420000000000002 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 75.310000000000002 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 74.239999999999995 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.349999999999994 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 62.130000000000003 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.510000000000005 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.109999999999999 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.510000000000005 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.120000000000005 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.430000000000007 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.549999999999997 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 72.310000000000002 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 74.219999999999999 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.340000000000003 107.017 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.329999999999998 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.109999999999999 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 73.430000000000007 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 75.340000000000003 109.068 -177.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 64.109999999999999 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 72.530000000000001 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.407 ' CE1' HD22 ' A' ' 64' ' ' ASN . 91.5 m-70 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.129999999999995 112.971 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 71.439999999999998 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.473 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 72.510000000000005 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.540000000000006 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.540000000000006 109.937 -157.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.409999999999997 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 74.319999999999993 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 73.409999999999997 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.140000000000001 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 63.25 108.261 175.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 73.319999999999993 114.351 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.149999999999999 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 75.319999999999993 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.130000000000003 110.517 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 75.540000000000006 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 75.409999999999997 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.349999999999994 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.230000000000004 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.409999999999997 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 75.239999999999995 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.329999999999998 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.409999999999997 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.340000000000003 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.430000000000007 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 75.439999999999998 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.230000000000004 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.539999999999999 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.230000000000004 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 71.25 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 63.409999999999997 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.407 HD22 ' CE1' ' A' ' 25' ' ' HIS . 70.2 m-80 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.329999999999998 111.355 -176.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 74.239999999999995 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 74.510000000000005 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.530000000000001 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.219999999999999 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.450000000000003 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 75.409999999999997 106.392 -166.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 75.25 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.219999999999999 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.209999999999994 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 72.150000000000006 106.688 168.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.549999999999997 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 75.540000000000006 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.439999999999998 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.530000000000001 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 74.519999999999996 106.127 163.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.446 -0.625 0 N-CA-C 108.135 -1.061 . . . . 74.329999999999998 108.135 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 64.400000000000006 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 73.010000000000005 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 75.209999999999994 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 74.420000000000002 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.420000000000002 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.430000000000007 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.030000000000001 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 64.140000000000001 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 62.020000000000003 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.310000000000002 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.109999999999999 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.409999999999997 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.140000000000001 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 73.340000000000003 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.219999999999999 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.458 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 73.239999999999995 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 75.140000000000001 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 75.140000000000001 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 73.329999999999998 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.219999999999999 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 74.040000000000006 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 74.150000000000006 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.030000000000001 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.019999999999996 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.040000000000006 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.420000000000002 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 75.109999999999999 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.129999999999995 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.120000000000005 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.349999999999994 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.150000000000006 106.352 166.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 . . . . . 0 CA--C 1.532 0.264 0 N-CA-C 112.118 0.414 . . . . 74.209999999999994 112.118 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.210000000000001 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.150000000000006 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.239999999999995 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.209999999999994 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 75.319999999999993 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.319999999999993 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.209999999999994 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.239999999999995 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 64.299999999999997 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 64.099999999999994 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.430000000000007 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.450000000000003 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 62.229999999999997 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.049999999999997 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.420000000000002 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.329999999999998 111.454 176.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.430000000000007 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.420000000000002 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 63.329999999999998 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.450000000000003 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 71.140000000000001 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.430000000000007 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 73.230000000000004 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 74.25 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.049999999999997 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 72.430000000000007 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 74.430000000000007 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 73.349999999999994 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 73.349999999999994 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 71.329999999999998 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 75.329999999999998 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 72.329999999999998 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.409999999999997 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 72.239999999999995 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.150000000000006 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 71.019999999999996 108.024 172.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 111.461 0.171 . . . . 73.319999999999993 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 74.329999999999998 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 71.120000000000005 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.439999999999998 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 72.409999999999997 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.409999999999997 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.230000000000004 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.420000000000002 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.400000000000006 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.239999999999995 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.030000000000001 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.349999999999994 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.010000000000005 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.439999999999998 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.420000000000002 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.319999999999993 110.744 176.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 74.299999999999997 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.299999999999997 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 75.019999999999996 109.813 172.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 75.329999999999998 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.519999999999996 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.541 ' CE1' HD22 ' A' ' 64' ' ' ASN . 38.4 m-70 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.140000000000001 111.423 176.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.129999999999995 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.030000000000001 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.230000000000004 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.420000000000002 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.349999999999994 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 72.329999999999998 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 75.209999999999994 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 73.219999999999999 109.341 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 119.218 -0.42 . . . . 75.209999999999994 111.988 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.109999999999999 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.150000000000006 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 74.209999999999994 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.109999999999999 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 74.239999999999995 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.349999999999994 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 74.109999999999999 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 72.150000000000006 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.329999999999998 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.409999999999997 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.450000000000003 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.230000000000004 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.129999999999995 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.239999999999995 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.239999999999995 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.010000000000005 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.230000000000004 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.010000000000005 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.541 HD22 ' CE1' ' A' ' 25' ' ' HIS . 65.8 m-80 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.439999999999998 110.778 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.239999999999995 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 23.7 m170 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 74.510000000000005 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.099999999999994 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 72.319999999999993 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 74.400000000000006 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.420000000000002 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 63.530000000000001 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.299999999999997 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.120000000000005 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 74.519999999999996 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 73.299999999999997 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.340000000000003 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 75.239999999999995 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 74.030000000000001 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.230000000000004 106.521 162.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.409999999999997 107.689 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 74.200000000000003 111.412 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 65.219999999999999 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.099999999999994 115.764 172.695 . . . . . . . . 4 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 73.010000000000005 108.58 167.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 73.439999999999998 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.209999999999994 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 63.149999999999999 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HB3' HE22 ' A' ' 73' ' ' GLN . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.350000000000001 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.439999999999998 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 74.040000000000006 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 53.229999999999997 112.57 -170.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 74.150000000000006 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.430000000000007 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.420000000000002 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 74.25 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 74.349999999999994 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 53.420000000000002 111.055 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.430000000000007 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.340000000000003 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 74.099999999999994 109.809 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 71.010000000000005 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.219999999999999 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 62.020000000000003 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.140000000000001 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 73.340000000000003 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.230000000000004 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 53.109999999999999 112.892 -164.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 74.219999999999999 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 72.099999999999994 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.409999999999997 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.43 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 74.409999999999997 110.813 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 119.391 -0.338 . . . . 71.340000000000003 111.622 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 70.040000000000006 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 65.310000000000002 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 64.0 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.430000000000007 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 61.020000000000003 106.981 168.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.230000000000004 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 63.0 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 73.420000000000002 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.430000000000007 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.219999999999999 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.030000000000001 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.340000000000003 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 64.030000000000001 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.340000000000003 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 71.019999999999996 113.543 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.099999999999994 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.430000000000007 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.019999999999996 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 73.420000000000002 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 71.409999999999997 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.400000000000006 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 72.319999999999993 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.049999999999997 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.319999999999993 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 72.120000000000005 108.541 -177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 73.209999999999994 111.689 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.310000000000002 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.472 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.150000000000006 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 75.209999999999994 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 72.140000000000001 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.430000000000007 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 62.020000000000003 110.078 165.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 72.420000000000002 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 74.019999999999996 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.430000000000007 108.125 178.543 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 118.979 -0.534 . . . . 74.430000000000007 111.649 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.340000000000003 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.319999999999993 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.439999999999998 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.120000000000005 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.239999999999995 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.430000000000007 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.400000000000006 108.453 167.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.219999999999999 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 74.310000000000002 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 75.120000000000005 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 72.310000000000002 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 75.329999999999998 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.409999999999997 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.120000000000005 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 75.319999999999993 107.56 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 74.030000000000001 110.313 -174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 75.439999999999998 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 74.200000000000003 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 74.030000000000001 108.108 172.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.329999999999998 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.209999999999994 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 70.099999999999994 107.361 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.230000000000004 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.452 ' CG1' ' CE2' ' A' ' 51' ' ' PHE . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 71.299999999999997 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.120000000000005 113.776 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 75.239999999999995 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.129999999999995 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.430000000000007 108.25 173.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.129999999999995 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.120000000000005 110.408 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 118.645 -0.693 . . . . 74.200000000000003 111.481 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.340000000000003 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 73.299999999999997 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 73.140000000000001 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.209999999999994 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 64.299999999999997 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 74.239999999999995 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 73.540000000000006 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.549999999999997 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.019999999999996 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.349999999999994 113.542 -176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.340000000000003 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.119999999999997 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.129999999999995 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 72.340000000000003 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 74.329999999999998 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.209999999999994 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.420000000000002 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.540000000000006 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 70.129999999999995 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.239999999999995 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.299999999999997 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 74.299999999999997 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.140000000000001 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 64.319999999999993 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 71.200000000000003 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 73.400000000000006 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 74.319999999999993 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.439999999999998 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.129999999999995 108.253 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 73.209999999999994 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.400000000000006 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 71.430000000000007 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.129999999999995 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 73.430000000000007 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.140000000000001 105.516 153.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 110.003 -0.369 . . . . 72.010000000000005 110.003 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.329999999999998 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.120000000000005 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 73.420000000000002 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 73.310000000000002 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.430000000000007 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.119999999999997 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 61.409999999999997 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.140000000000001 110.749 173.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.239999999999995 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 73.510000000000005 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.310000000000002 111.669 -167.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.430000000000007 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.420000000000002 110.348 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 71.340000000000003 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.439999999999998 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.109999999999999 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.120000000000005 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 52.539999999999999 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 75.439999999999998 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 71.430000000000007 109.365 168.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.329999999999998 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.109999999999999 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.219999999999999 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 62.310000000000002 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 74.209999999999994 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.150000000000006 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 74.329999999999998 109.168 152.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.420000000000002 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.299999999999997 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 63.43 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.140000000000001 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.030000000000001 106.983 169.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 112.082 0.401 . . . . 74.530000000000001 112.082 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.430000000000007 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 62.409999999999997 110.254 -163.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.329999999999998 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 62.420000000000002 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 72.409999999999997 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.140000000000001 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.049999999999997 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.420000000000002 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.049999999999997 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.120000000000005 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.109999999999999 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.319999999999993 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 72.030000000000001 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.450000000000003 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.439999999999998 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.340000000000003 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.310000000000002 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.150000000000006 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 74.140000000000001 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 73.519999999999996 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.120000000000005 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.120000000000005 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.120000000000005 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 74.430000000000007 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.140000000000001 106.618 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.430000000000007 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 72.549999999999997 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 73.25 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 75.439999999999998 106.327 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 72.239999999999995 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.420000000000002 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.540000000000006 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 75.530000000000001 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.439999999999998 110.298 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 N--CA 1.466 0.367 0 CA-C-O 118.925 -0.559 . . . . 70.109999999999999 111.928 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.540000000000006 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.239999999999995 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.450000000000003 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.239999999999995 110.569 -177.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 73.420000000000002 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.219999999999999 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.510000000000005 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.450000000000003 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.129999999999995 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.409999999999997 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 64.129999999999995 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.510000000000005 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 75.310000000000002 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.239999999999995 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 75.209999999999994 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 75.310000000000002 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 71.450000000000003 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.140000000000001 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.400000000000006 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 73.329999999999998 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.420000000000002 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.530000000000001 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 74.219999999999999 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.530000000000001 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.519999999999996 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.430000000000007 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 72.549999999999997 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 72.530000000000001 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 74.150000000000006 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 118.261 -0.876 . . . . 74.140000000000001 111.732 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.219999999999999 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 75.319999999999993 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 61.530000000000001 110.565 165.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.120000000000005 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 62.340000000000003 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.510000000000005 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 64.329999999999998 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.5 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 72.340000000000003 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 72.219999999999999 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.120000000000005 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.219999999999999 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.219999999999999 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.120000000000005 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.219999999999999 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.109999999999999 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 73.200000000000003 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 72.310000000000002 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 71.120000000000005 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.439999999999998 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 72.420000000000002 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 65.140000000000001 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 45.240000000000002 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.409999999999997 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.319999999999993 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 74.209999999999994 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.230000000000004 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.43 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.030000000000001 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.540000000000006 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.530000000000001 105.978 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.030000000000001 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.120000000000005 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.239999999999995 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.439999999999998 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.340000000000003 109.469 176.275 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.913 -1.041 . . . . 74.310000000000002 109.208 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 73.319999999999993 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.549999999999997 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.230000000000004 107.142 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.310000000000002 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.040000000000006 109.02 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 74.25 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.340000000000003 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.219999999999999 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.420000000000002 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 63.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.329999999999998 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.119999999999997 109.842 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.310000000000002 110.323 172.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 72.140000000000001 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.319999999999993 111.459 174.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 75.510000000000005 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.310000000000002 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 71.140000000000001 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 71.120000000000005 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.120000000000005 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 72.349999999999994 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.310000000000002 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.109999999999999 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.409999999999997 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.230000000000004 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.150000000000006 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 72.510000000000005 108.335 151.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.230000000000004 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 70.530000000000001 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 72.209999999999994 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 75.230000000000004 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.510000000000005 108.146 -179.755 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.430000000000007 115.661 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.210000000000001 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 75.430000000000007 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.549999999999997 109.157 164.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.329999999999998 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 73.530000000000001 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 74.219999999999999 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.329999999999998 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.140000000000001 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 73.530000000000001 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 73.049999999999997 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.219999999999999 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.120000000000005 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 71.540000000000006 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 63.509999999999998 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.239999999999995 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 72.409999999999997 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.510000000000005 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.239999999999995 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 72.230000000000004 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.439999999999998 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 73.5 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.510000000000005 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.540000000000006 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 74.25 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 65.209999999999994 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 75.439999999999998 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.109999999999999 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 71.140000000000001 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.310000000000002 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.530000000000001 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.230000000000004 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.519999999999996 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.540000000000006 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 74.310000000000002 107.133 169.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 74.329999999999998 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 72.230000000000004 108.996 175.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.191 0 N-CA-C 109.175 -0.676 . . . . 51.140000000000001 109.175 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 61.229999999999997 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.439999999999998 108.554 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.140000000000001 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.430000000000007 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 74.439999999999998 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.230000000000004 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.120000000000005 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.577 ' HB3' HE21 ' A' ' 73' ' ' GLN . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.140000000000001 111.723 163.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.310000000000002 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.329999999999998 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 71.040000000000006 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 74.030000000000001 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.310000000000002 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 62.229999999999997 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.239999999999995 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.450000000000003 108.631 176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 70.430000000000007 110.46 -174.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.329999999999998 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.430000000000007 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 72.319999999999993 110.339 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.319999999999993 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.140000000000001 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.476 ' CE1' HD22 ' A' ' 64' ' ' ASN . 76.7 m-70 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 75.010000000000005 112.325 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 54.539999999999999 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 75.430000000000007 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.310000000000002 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.310000000000002 111.472 -152.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 75.329999999999998 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.310000000000002 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 tm? . . . . . 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 71.310000000000002 109.239 167.893 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 114.385 1.254 . . . . 75.209999999999994 114.385 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 72.329999999999998 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.009999999999998 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.009999999999998 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.409999999999997 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.329999999999998 105.288 162.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.319999999999993 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 74.209999999999994 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.420000000000002 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 64.439999999999998 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.120000000000005 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 75.230000000000004 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 72.219999999999999 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.544 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 75.349999999999994 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.109999999999999 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 71.049999999999997 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 72.219999999999999 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.109999999999999 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.230000000000004 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.340000000000003 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.476 HD22 ' CE1' ' A' ' 25' ' ' HIS . 62.7 m-80 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 75.150000000000006 111.768 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.439999999999998 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.209999999999994 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.450000000000003 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 75.340000000000003 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.329999999999998 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 75.319999999999993 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.349999999999994 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.230000000000004 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.577 HE21 ' HB3' ' A' ' 10' ' ' PRO . 2.2 pm0 -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.150000000000006 110.209 -177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.409999999999997 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.310000000000002 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 71.230000000000004 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 74.140000000000001 110.081 170.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.239999999999995 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.040000000000006 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 60.310000000000002 108.976 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.018 -0.992 . . . . 73.319999999999993 110.543 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -116.13 -3.75 12.02 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.277 1.399 . . . . 75.140000000000001 112.381 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.510000000000005 108.068 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.510000000000005 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 61.149999999999999 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.150000000000006 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.592 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.310000000000002 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 73.340000000000003 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 64.430000000000007 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.240000000000002 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.229999999999997 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.229999999999997 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 64.230000000000004 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 74.230000000000004 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.350000000000001 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.340000000000003 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.319999999999993 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 74.120000000000005 110.122 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 63.409999999999997 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 73.25 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 71.409999999999997 108.424 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.439999999999998 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 63.140000000000001 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 74.209999999999994 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 74.510000000000005 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 55.409999999999997 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.219999999999999 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.239999999999995 108.347 151.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 73.109999999999999 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 71.439999999999998 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 74.230000000000004 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.150000000000006 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -145.32 115.3 7.4 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.329999999999998 107.172 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.35 1.1 ptp 43.87 -154.51 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.057 1.743 . . . . 75.439999999999998 112.738 -171.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 75.71 -48.44 0.6 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.161 2.984 . . . . 75.549999999999997 113.841 165.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -50.71 -39.06 50.58 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.368 1.867 . . . . 74.540000000000006 111.958 -175.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 47.05 -66.5 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.753 2.421 . . . . 73.329999999999998 114.106 -144.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.0 t -49.04 -66.65 0.36 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.412 1.885 . . . . 51.409999999999997 111.72 -161.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 t -66.51 -33.55 75.93 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.268 0.355 . . . . 72.310000000000002 110.753 -170.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.83 21.41 2.64 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-O 117.811 -1.55 . . . . 73.239999999999995 113.719 161.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.47 4.0 0.61 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.49 1.663 . . . . 75.109999999999999 115.49 -165.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.21 72.13 0.78 Allowed 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 126.617 1.967 . . . . 53.049999999999997 108.431 -168.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -133.4 -6.16 2.95 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 73.409999999999997 114.635 -173.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.439999999999998 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.420000000000002 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.539999999999999 110.169 168.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.310000000000002 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.340000000000003 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.209999999999994 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 74.540000000000006 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.530000000000001 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.349999999999994 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.519999999999996 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 75.120000000000005 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 74.25 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 74.239999999999995 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.430000000000007 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 72.329999999999998 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 72.25 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 73.310000000000002 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 72.519999999999996 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 73.340000000000003 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.420000000000002 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 63.140000000000001 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 65.120000000000005 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.230000000000004 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 71.430000000000007 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.140000000000001 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 72.540000000000006 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 72.310000000000002 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.310000000000002 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.540000000000006 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 64.230000000000004 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.129999999999995 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.120000000000005 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.592 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.129999999999995 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.439999999999998 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t -75.73 -6.68 51.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.039999999999999 114.711 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -171.51 166.38 4.14 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 124.98 1.312 . . . . 55.329999999999998 108.804 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -68.9 -56.15 0.18 Allowed 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 121.245 1.297 . . . . 53.340000000000003 111.615 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -160.1 158.11 25.9 Favored Pre-proline 0 C--O 1.238 0.454 0 C-N-CA 127.234 2.214 . . . . 75.230000000000004 109.258 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.14 106.41 1.54 Allowed 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 124.516 3.478 . . . . 75.129999999999995 108.905 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -109.19 19.46 19.43 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.5 1.12 . . . . 75.120000000000005 112.435 -175.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.454 HD11 ' H ' ' A' ' 86' ' ' ILE . 1.8 mp -62.01 153.53 5.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 107.067 -1.457 . . . . 74.150000000000006 107.067 169.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -5.32 57.93 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 64.530000000000001 112.329 176.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -120.99 159.57 25.33 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 129.13 2.972 . . . . 73.239999999999995 108.726 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -144.56 11.61 1.47 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.38 1.472 . . . . 74.209999999999994 111.129 -175.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -135.37 8.25 3.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.807 2.443 . . . . 74.310000000000002 111.827 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 C--O 1.248 0.976 0 CA-C-O 116.465 -1.731 . . . . 73.140000000000001 107.103 174.417 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 117.79 -1.1 . . . . 72.420000000000002 110.19 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -143.0 13.36 1.86 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.775 1.625 . . . . 73.109999999999999 114.686 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 74.430000000000007 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.420000000000002 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.519999999999996 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.400000000000006 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.230000000000004 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 74.400000000000006 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.240000000000002 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.310000000000002 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.099999999999994 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.400000000000006 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.409999999999997 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 73.129999999999995 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.519999999999996 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.530000000000001 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.430000000000007 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.540000000000006 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 70.140000000000001 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.109999999999999 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 74.299999999999997 109.054 -177.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.400000000000006 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 73.5 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.439999999999998 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 62.219999999999999 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.400000000000006 109.066 -171.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 73.409999999999997 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 71.319999999999993 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 74.319999999999993 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.420000000000002 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.5 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 73.209999999999994 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 35' ' ' MET . 1.8 tm? -87.71 164.0 16.23 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 74.319999999999993 110.258 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.44 ' H ' HD23 ' A' ' 34' ' ' LEU . 45.0 mtp -54.32 87.54 0.0 OUTLIER 'General case' 0 C--O 1.236 0.374 0 C-N-CA 127.816 2.446 . . . . 72.319999999999993 111.966 168.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.53 -74.28 0.34 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.256 2.223 . . . . 71.329999999999998 108.081 169.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 63.3 t-20 -64.24 94.37 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.7 1.6 . . . . 73.099999999999994 113.01 -169.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -33.54 76.09 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 118.335 -0.841 . . . . 63.109999999999999 112.943 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -43.67 71.3 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.491 0.587 . . . . 64.129999999999995 110.79 -173.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.4 t -63.1 -58.73 6.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.062 -1.088 . . . . 64.030000000000001 108.062 168.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.403 ' C ' ' H ' ' A' ' 43' ' ' SER . . . 108.44 38.55 1.92 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.939 -1.264 . . . . 73.420000000000002 109.939 -169.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.73 5.03 3.42 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.813 0.806 . . . . 74.239999999999995 111.503 169.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 41' ' ' GLY . 11.3 p -131.01 102.78 6.18 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.348 1.459 . . . . 72.219999999999999 109.701 -158.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -153.53 0.21 0.24 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.109999999999999 114.876 -172.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.340000000000003 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.099999999999994 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.120000000000005 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.209999999999994 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 65.209999999999994 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.319999999999993 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 74.409999999999997 109.59 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.230000000000004 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 74.439999999999998 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.430000000000007 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.439999999999998 112.286 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 74.540000000000006 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 71.319999999999993 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 74.519999999999996 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 72.409999999999997 112.885 -176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.200000000000003 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.200000000000003 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.439999999999998 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.200000000000003 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 72.510000000000005 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.140000000000001 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.400000000000006 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.530000000000001 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 72.230000000000004 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.519999999999996 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.429 ' C ' ' H ' ' A' ' 72' ' ' GLY . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.420000000000002 106.774 -168.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 74.439999999999998 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.429 ' H ' ' C ' ' A' ' 70' ' ' ILE . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.439999999999998 112.131 -174.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.239999999999995 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 74.420000000000002 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 72.219999999999999 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.329999999999998 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.510000000000005 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.420000000000002 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.310000000000002 111.85 175.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.03 61.56 2.97 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.120000000000005 109.547 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -51.48 155.38 2.64 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 125.768 1.627 . . . . 73.099999999999994 113.899 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.02 -45.56 7.69 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 121.868 1.712 . . . . 73.409999999999997 111.578 -174.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt 58.1 164.95 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 131.312 3.845 . . . . 71.040000000000006 113.397 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.99 106.21 1.11 Allowed 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.237 1.958 . . . . 74.140000000000001 109.153 165.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -117.49 26.35 9.79 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.28 1.432 . . . . 72.040000000000006 111.863 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.18 158.84 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 O-C-N 120.244 -1.535 . . . . 74.200000000000003 107.843 -177.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.21 137.04 35.89 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.606 -1.257 . . . . 72.010000000000005 107.606 169.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.8 71.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 123.851 1.786 . . . . 74.040000000000006 110.167 -168.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -74.48 -15.08 60.9 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 113.39 -1.732 . . . . 72.239999999999995 112.742 -167.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -130.16 4.28 4.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.827 1.651 . . . . 73.019999999999996 113.031 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 C--O 1.244 0.804 0 N-CA-C 103.877 -2.638 . . . . 74.400000000000006 103.877 168.009 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.251 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 116.994 -1.479 . . . . 64.329999999999998 114.772 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 76.34 -2.51 2.71 Favored 'General case' 0 C--N 1.349 0.565 0 C-N-CA 127.74 2.416 . . . . 61.149999999999999 111.332 -166.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.420000000000002 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 71.450000000000003 105.923 161.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 75.420000000000002 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.409999999999997 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.540000000000006 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 75.439999999999998 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 75.319999999999993 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.010000000000005 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.039999999999999 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 71.340000000000003 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.319999999999993 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.420000000000002 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.140000000000001 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.200000000000003 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 75.299999999999997 110.779 -172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.400000000000006 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.230000000000004 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.209999999999994 108.823 176.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.340000000000003 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.430000000000007 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.009999999999998 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.299999999999997 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.329999999999998 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 75.439999999999998 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.420000000000002 114.06 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 75.409999999999997 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.350000000000001 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.310000000000002 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.319999999999993 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.427 HD13 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -140.53 -152.82 0.43 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.209999999999994 106.736 176.653 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.427 ' H ' HD13 ' A' ' 34' ' ' LEU . 5.8 ttp 69.49 -153.39 0.14 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.85 1.66 . . . . 75.140000000000001 109.347 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.6 149.92 42.96 Favored 'General case' 0 CA--C 1.497 -1.087 0 C-N-CA 125.726 1.61 . . . . 73.420000000000002 107.997 -177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -153.24 -50.68 0.1 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.925 0.869 . . . . 74.439999999999998 112.48 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.08 -24.16 0.07 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 116.899 2.185 . . . . 75.310000000000002 116.899 -174.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.2 m -76.53 -74.96 0.21 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.203 1.365 . . . . 55.329999999999998 108.021 162.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -70.79 -26.45 63.33 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.289 0.949 . . . . 74.549999999999997 113.519 -169.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.34 16.29 27.71 Favored Glycine 0 C--N 1.339 0.748 0 O-C-N 120.888 -1.133 . . . . 73.5 113.095 161.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -62.98 4.33 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.386 2.675 . . . . 73.219999999999999 115.991 -173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 99.7 p -141.47 106.08 4.88 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.463 -1.31 . . . . 75.540000000000006 107.463 -156.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -142.72 14.98 1.95 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.71 0.804 . . . . 74.519999999999996 112.377 -172.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 60.109999999999999 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.310000000000002 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.340000000000003 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 73.420000000000002 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.519999999999996 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 73.530000000000001 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.239999999999995 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 75.340000000000003 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 73.430000000000007 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.549999999999997 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.129999999999995 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.120000000000005 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 75.530000000000001 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.209999999999994 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.41 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.310000000000002 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.230000000000004 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 74.120000000000005 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 74.420000000000002 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 75.409999999999997 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 75.200000000000003 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.319999999999993 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.219999999999999 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 74.219999999999999 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 75.319999999999993 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.200000000000003 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.019999999999996 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.439999999999998 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 73.439999999999998 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.109999999999999 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.219999999999999 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 74.409999999999997 109.961 171.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.200000000000003 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.41 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.219999999999999 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t -144.18 53.34 1.28 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -45.01 144.62 1.91 Allowed Pre-proline 0 N--CA 1.464 0.236 0 C-N-CA 125.204 1.402 . . . . 75.120000000000005 114.02 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -67.89 -35.57 20.57 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.877 1.718 . . . . 74.140000000000001 110.247 -173.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -140.04 158.24 67.58 Favored Pre-proline 0 N--CA 1.451 -0.404 0 C-N-CA 124.523 1.129 . . . . 74.109999999999999 110.297 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.06 99.86 1.04 Allowed 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.115 2.543 . . . . 72.450000000000003 109.773 173.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -102.94 31.44 4.2 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.255 1.022 . . . . 74.450000000000003 110.915 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.1 mp -69.91 167.42 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.414 1.485 . . . . 73.129999999999995 108.631 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -101.71 153.16 20.04 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.304 -1.497 . . . . 71.230000000000004 108.143 165.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 44.22 65.66 1.0 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 128.735 2.814 . . . . 72.530000000000001 112.712 174.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.75 -40.51 63.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.325 0.65 . . . . 74.519999999999996 111.216 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 50.9 p-90 -89.34 1.71 55.39 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.374 1.469 . . . . 73.310000000000002 112.482 -171.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.25 1.086 0 N-CA-C 105.546 -2.02 . . . . 75.109999999999999 105.546 171.911 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.291 4.0 m . . . . . 0 N--CA 1.473 0.72 0 CA-C-O 115.912 -1.994 . . . . 64.239999999999995 112.703 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER 54.13 20.71 2.65 Favored 'General case' 0 C--N 1.349 0.584 0 C-N-CA 127.528 2.331 . . . . 72.120000000000005 112.568 -170.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.219999999999999 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.299999999999997 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.299999999999997 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.229999999999997 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.219999999999999 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.229999999999997 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 74.109999999999999 109.308 163.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.209999999999994 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.409999999999997 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.340000000000003 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.400000000000006 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.129999999999995 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.439999999999998 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.319999999999993 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.130000000000003 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.219999999999999 109.266 -174.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.340000000000003 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.329999999999998 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.129999999999995 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 74.319999999999993 108.332 178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.439999999999998 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.439999999999998 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.448 ' CD2' HD22 ' A' ' 64' ' ' ASN . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.239999999999995 112.547 175.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 74.200000000000003 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 74.340000000000003 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.109999999999999 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 74.400000000000006 108.672 157.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.540000000000006 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 70.219999999999999 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 73.239999999999995 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.530000000000001 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.78 88.33 2.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.200000000000003 108.608 165.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.5 ptm -168.65 142.33 3.07 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.354 0.979 . . . . 74.200000000000003 110.92 154.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -48.76 112.19 0.57 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 125.183 1.393 . . . . 74.099999999999994 110.748 -175.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -160.45 106.02 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.104 0.962 . . . . 72.439999999999998 112.088 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 1.6 2.14 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 115.686 1.735 . . . . 74.219999999999999 115.686 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.79 -2.1 18.78 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.917 1.687 . . . . 52.229999999999997 112.162 -177.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.3 m -131.13 -40.36 1.15 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.757 1.223 . . . . 72.25 109.416 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.71 54.34 2.96 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 107.744 -2.142 . . . . 65.540000000000006 107.744 -172.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -91.2 -177.14 4.8 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 124.376 0.692 . . . . 72.5 110.138 168.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.05 -152.81 0.21 Allowed 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.715 -0.616 . . . . 73.439999999999998 110.961 164.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.37 -3.14 2.66 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 127.559 2.344 . . . . 74.430000000000007 112.947 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.020000000000003 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.519999999999996 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.420000000000002 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.209999999999994 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 72.120000000000005 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.540000000000006 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 73.099999999999994 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 71.530000000000001 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.540000000000006 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 74.200000000000003 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.520000000000003 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.519999999999996 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 62.329999999999998 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 74.140000000000001 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 73.430000000000007 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.209999999999994 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 74.420000000000002 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 72.299999999999997 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.448 HD22 ' CD2' ' A' ' 25' ' ' HIS . 64.0 m-80 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 73.200000000000003 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.310000000000002 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.299999999999997 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.140000000000001 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 74.0 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.319999999999993 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.120000000000005 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 63.130000000000003 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.420000000000002 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.319999999999993 106.599 170.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.329999999999998 108.244 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.519999999999996 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.219999999999999 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.239999999999995 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.530000000000001 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t -146.9 -159.19 0.99 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.420000000000002 108.814 160.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.05 165.03 38.91 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 128.673 2.789 . . . . 72.5 109.687 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.04 -28.73 10.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 121.606 1.537 . . . . 54.229999999999997 114.006 -168.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt 54.32 155.15 0.05 OUTLIER Pre-proline 0 C--O 1.239 0.501 0 C-N-CA 129.788 3.235 . . . . 74.540000000000006 114.569 -164.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.4 101.99 0.92 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 N-CA-C 107.701 -1.692 . . . . 65.549999999999997 107.701 162.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -118.77 15.6 13.52 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 127.066 2.146 . . . . 74.420000000000002 112.137 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.5 mp -67.17 137.16 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 N-CA-C 105.694 -1.965 . . . . 71.150000000000006 105.694 164.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -5.78 19.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.302 1.223 . . . . 74.540000000000006 114.302 175.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -143.36 122.36 12.81 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 126.913 2.085 . . . . 72.439999999999998 106.975 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.71 5.61 47.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.818 1.247 . . . . 74.510000000000005 111.705 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 46.7 p-90 -135.84 6.97 3.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 125.461 1.504 . . . . 74.340000000000003 112.762 -173.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--O 1.248 1.018 0 CA-C-O 115.393 -2.241 . . . . 71.230000000000004 108.521 -179.986 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.275 19.5 m . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 116.34 -1.79 . . . . 70.329999999999998 110.482 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 44.33 37.4 1.97 Allowed 'General case' 0 C--N 1.351 0.646 0 C-N-CA 126.214 1.805 . . . . 73.329999999999998 109.912 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.310000000000002 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.209999999999994 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.340000000000003 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.340000000000003 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.140000000000001 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.019999999999996 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 74.030000000000001 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.150000000000006 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.230000000000004 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.430000000000007 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 73.030000000000001 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.010000000000005 111.845 -176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.349999999999994 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 71.129999999999995 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.009999999999998 109.286 172.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.450000000000003 109.191 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.349999999999994 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.439999999999998 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.349999999999994 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.420000000000002 110.923 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.409999999999997 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.329999999999998 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.416 ' CE1' HD22 ' A' ' 64' ' ' ASN . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.230000000000004 111.687 163.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.010000000000005 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.409999999999997 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.439999999999998 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.230000000000004 114.317 -170.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.140000000000001 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.439999999999998 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 73.530000000000001 111.674 -167.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 73.019999999999996 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 35' ' ' MET . 1.7 tm? -84.14 159.31 21.1 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.219999999999999 109.986 172.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.447 ' H ' HD23 ' A' ' 34' ' ' LEU . 66.6 mtp -46.18 77.17 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 131.456 3.903 . . . . 72.420000000000002 114.479 170.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.5 mtp180 -131.18 -67.04 0.72 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 108.428 -0.952 . . . . 72.549999999999997 108.428 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.51 116.25 5.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.646 1.178 . . . . 72.530000000000001 108.705 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.7 -23.74 29.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.519 0.933 . . . . 74.209999999999994 113.519 171.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.6 t -86.17 -24.29 26.2 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.488 1.04 . . . . 70.209999999999994 111.5 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -81.0 -63.47 1.4 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.048 -1.032 . . . . 71.25 110.356 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 43' ' ' SER . . . 131.96 2.63 4.22 Favored Glycine 0 N--CA 1.466 0.659 0 CA-C-O 119.868 -0.407 . . . . 70.030000000000001 113.136 -165.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -69.58 14.45 0.1 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.849 1.659 . . . . 65.109999999999999 111.906 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.437 ' H ' ' C ' ' A' ' 41' ' ' GLY . 7.1 p -133.7 98.72 4.26 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.44 1.896 . . . . 74.239999999999995 111.124 -178.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.53 13.34 0.64 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 72.049999999999997 114.928 -176.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.420000000000002 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.430000000000007 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 62.409999999999997 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 72.329999999999998 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.439999999999998 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.200000000000003 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.099999999999994 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.540000000000006 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.329999999999998 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 73.120000000000005 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 72.140000000000001 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.109999999999999 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 71.430000000000007 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.209999999999994 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.140000000000001 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.129999999999995 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.439999999999998 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 71.340000000000003 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.409999999999997 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.416 HD22 ' CE1' ' A' ' 25' ' ' HIS . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 74.319999999999993 113.073 168.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 52.329999999999998 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.400000000000006 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 74.230000000000004 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 73.209999999999994 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 74.010000000000005 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 72.450000000000003 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.430000000000007 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 74.129999999999995 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.319999999999993 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.140000000000001 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 74.120000000000005 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.310000000000002 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.129999999999995 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.019999999999996 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.200000000000003 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t -142.97 171.67 13.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.200000000000003 107.064 173.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -129.28 150.82 76.57 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.174 -1.417 . . . . 73.310000000000002 107.174 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.95 -25.01 20.19 Favored 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.114 1.876 . . . . 74.340000000000003 114.856 -160.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt 60.99 163.35 0.1 Allowed Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 130.223 3.409 . . . . 73.540000000000006 113.193 -170.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -71.67 103.52 1.46 Allowed 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.089 1.86 . . . . 74.540000000000006 108.145 166.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -89.97 62.89 5.77 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 123.353 1.549 . . . . 63.210000000000001 110.0 -170.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.3 mm -93.57 164.97 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.071 -1.455 . . . . 73.439999999999998 107.071 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -80.64 135.0 35.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.998 -1.482 . . . . 74.209999999999994 106.998 161.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 44.07 56.91 4.49 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 127.523 2.329 . . . . 72.329999999999998 111.901 158.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -78.59 -4.67 49.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 113.569 -1.651 . . . . 73.430000000000007 113.342 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 36.3 p-90 -123.71 9.88 8.95 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 128.151 2.58 . . . . 73.519999999999996 111.353 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.253 1.279 0 N-CA-C 104.214 -2.513 . . . . 74.230000000000004 104.214 161.395 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 111.804 0.298 . . . . 64.129999999999995 111.804 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -135.56 22.73 3.4 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.459 1.504 . . . . 73.340000000000003 110.624 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 73.549999999999997 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.450000000000003 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 65.120000000000005 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.310000000000002 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.452 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.420000000000002 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.150000000000006 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.140000000000001 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.120000000000005 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 64.310000000000002 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.120000000000005 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 74.209999999999994 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.510000000000005 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 75.25 109.719 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.439999999999998 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.340000000000003 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 72.140000000000001 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 73.219999999999999 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 71.349999999999994 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 74.230000000000004 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 71.310000000000002 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 64.349999999999994 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.319999999999993 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.549999999999997 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.020000000000003 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.519999999999996 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 73.25 107.224 167.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 70.349999999999994 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 75.150000000000006 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.420000000000002 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 73.450000000000003 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.030000000000001 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.473 ' CD2' ' H ' ' A' ' 35' ' ' MET . 4.7 tt -109.22 -173.86 2.37 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 75.120000000000005 108.766 164.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.473 ' H ' ' CD2' ' A' ' 34' ' ' LEU . 30.3 mtp -48.19 130.97 16.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.938 2.095 . . . . 75.319999999999993 110.354 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.87 -56.79 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.983 2.513 . . . . 63.25 108.327 171.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -77.27 -11.54 59.84 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.041 -0.981 . . . . 73.430000000000007 112.577 -159.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.322 0.0 OUTLIER 44.39 -66.82 0.0 OUTLIER 'General case' 0 C--N 1.345 0.398 0 C-N-CA 130.867 3.667 . . . . 73.209999999999994 114.267 -170.554 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.6 t -60.98 -54.05 49.76 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.093 2.557 . . . . 75.310000000000002 110.032 -166.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 t -55.15 -35.72 65.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.955 0.502 . . . . 75.420000000000002 111.991 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 43' ' ' SER . . . 123.89 7.2 6.76 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 118.412 0.551 . . . . 64.230000000000004 113.202 167.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -64.69 14.28 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.03 2.132 . . . . 75.319999999999993 112.599 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.435 ' H ' ' C ' ' A' ' 41' ' ' GLY . 8.0 t -140.91 85.43 1.99 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.824 2.05 . . . . 74.140000000000001 105.942 -177.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -145.17 7.92 1.19 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.182 2.193 . . . . 74.319999999999993 110.958 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.329999999999998 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 71.530000000000001 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 74.540000000000006 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.549999999999997 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.407 HG12 ' CE1' ' A' ' 51' ' ' PHE . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.420000000000002 105.693 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.239999999999995 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.407 ' CE1' HG12 ' A' ' 49' ' ' VAL . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.409999999999997 111.813 -164.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.140000000000001 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.049999999999997 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 72.450000000000003 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.310000000000002 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.209999999999994 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.520000000000003 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 73.109999999999999 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.540000000000006 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 74.239999999999995 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.407 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 62.549999999999997 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.150000000000006 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.039999999999999 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.349999999999994 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 74.120000000000005 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.519999999999996 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 74.109999999999999 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 71.150000000000006 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.420000000000002 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 74.420000000000002 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.230000000000004 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.210000000000001 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.109999999999999 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 63.240000000000002 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 72.510000000000005 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.407 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.409999999999997 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.452 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 71.239999999999995 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 74.349999999999994 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -88.13 57.17 4.16 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 73.340000000000003 108.767 171.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -49.87 154.73 1.72 Allowed Pre-proline 0 N--CA 1.471 0.579 0 C-N-CA 124.238 1.015 . . . . 71.150000000000006 112.246 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -66.25 -39.63 17.26 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 121.459 1.439 . . . . 65.219999999999999 110.473 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 pttt 55.77 165.79 0.06 OUTLIER Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 128.635 2.774 . . . . 73.540000000000006 112.693 -171.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.47 101.73 0.45 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 N-CA-C 108.029 -1.566 . . . . 65.310000000000002 108.029 165.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -105.67 17.25 24.07 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.977 1.711 . . . . 72.230000000000004 111.701 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.41 HD11 ' H ' ' A' ' 86' ' ' ILE . 2.4 mp -71.14 166.49 2.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 125.649 1.58 . . . . 72.140000000000001 107.889 -176.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -162.02 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.735 1.214 . . . . 63.25 110.663 158.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 117.56 5.63 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 119.798 -1.814 . . . . 74.319999999999993 110.432 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.86 -0.91 29.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.145 2.178 . . . . 74.420000000000002 112.91 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -122.14 6.84 9.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.831 1.652 . . . . 74.349999999999994 111.522 176.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.25 1.087 0 N-CA-C 105.746 -1.946 . . . . 74.450000000000003 105.746 163.563 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 118.51 -0.757 . . . . 73.019999999999996 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -122.21 1.2 9.68 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.582 1.953 . . . . 71.120000000000005 113.275 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 73.109999999999999 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 74.430000000000007 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.310000000000002 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.340000000000003 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 74.340000000000003 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.430000000000007 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.319999999999993 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.340000000000003 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.129999999999995 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 72.420000000000002 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 72.340000000000003 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.109999999999999 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 73.329999999999998 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.299999999999997 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.310000000000002 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 73.319999999999993 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.519999999999996 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 73.219999999999999 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.400000000000006 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 75.099999999999994 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.400000000000006 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.510000000000005 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.514 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 52.409999999999997 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.340000000000003 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.319999999999993 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.239999999999995 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.319999999999993 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.150000000000006 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.340000000000003 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.409999999999997 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -91.5 167.85 11.95 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 74.530000000000001 107.986 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -55.25 16.96 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.861 2.864 . . . . 71.329999999999998 117.382 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.7 mtp85 -130.02 105.11 7.74 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.114 -1.617 . . . . 73.439999999999998 108.724 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -154.04 135.18 13.97 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.862 1.265 . . . . 72.540000000000006 111.096 168.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -51.36 61.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.231 1.413 . . . . 74.409999999999997 110.888 170.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -23.21 65.46 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 115.727 1.751 . . . . 51.130000000000003 115.727 -168.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.3 -25.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.243 0.929 . . . . 72.140000000000001 112.872 -177.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.76 -27.07 12.67 Favored Glycine 0 C--O 1.225 -0.434 0 CA-C-O 118.796 -1.002 . . . . 71.109999999999999 112.015 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 45.84 31.75 1.12 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.985 2.514 . . . . 72.230000000000004 113.107 -175.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -115.64 97.93 6.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.662 1.585 . . . . 74.310000000000002 110.716 -150.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 -148.46 -5.09 0.44 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.340000000000003 115.296 -176.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 71.010000000000005 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.230000000000004 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.420000000000002 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 73.400000000000006 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.430000000000007 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.430000000000007 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 75.430000000000007 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.299999999999997 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 74.219999999999999 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.409999999999997 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 75.299999999999997 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.510000000000005 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.200000000000003 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.319999999999993 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 75.540000000000006 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.219999999999999 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 70.340000000000003 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.299999999999997 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.019999999999996 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.099999999999994 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.040000000000006 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 m170 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.340000000000003 114.908 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 72.209999999999994 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 74.209999999999994 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.209999999999994 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 74.129999999999995 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 73.140000000000001 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.430000000000007 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.040000000000006 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.200000000000003 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.420000000000002 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 72.400000000000006 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.200000000000003 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.329999999999998 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t -84.03 70.64 10.51 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.219999999999999 108.148 173.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.52 163.5 14.85 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 112.903 0.705 . . . . 73.019999999999996 112.903 -168.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.74 -24.94 9.73 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 121.414 1.409 . . . . 62.409999999999997 113.214 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 42.8 pttt 54.13 165.84 0.05 OUTLIER Pre-proline 0 C--N 1.343 0.3 0 C-N-CA 129.736 3.214 . . . . 74.140000000000001 115.264 -173.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.46 105.41 1.06 Allowed 'Trans proline' 0 N--CA 1.444 -1.404 0 N-CA-C 107.363 -1.822 . . . . 73.239999999999995 107.363 159.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -112.79 21.55 15.41 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.815 1.246 . . . . 72.510000000000005 110.991 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.406 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.1 mp -72.52 144.44 13.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.121 -1.066 . . . . 74.140000000000001 108.121 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.02 113.97 8.6 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.611 -1.255 . . . . 73.209999999999994 107.611 169.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.88 67.38 0.75 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 128.789 2.836 . . . . 72.010000000000005 114.253 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.73 -24.82 67.88 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.922 1.289 . . . . 71.329999999999998 113.736 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 68.8 p-90 -106.2 4.79 29.3 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 121.337 -0.852 . . . . 72.409999999999997 113.262 -174.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.243 0.738 0 N-CA-C 107.247 -1.39 . . . . 64.239999999999995 107.247 163.065 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.643 -0.694 . . . . 74.219999999999999 110.137 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -132.37 28.43 4.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.04 0.837 . . . . 74.25 111.271 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 73.340000000000003 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 65.540000000000006 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.540000000000006 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 72.010000000000005 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 73.340000000000003 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 73.430000000000007 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 74.219999999999999 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.510000000000005 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.209999999999994 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.420000000000002 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 73.549999999999997 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.423 ' H ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.450000000000003 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.319999999999993 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.040000000000006 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 72.040000000000006 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.120000000000005 113.122 -169.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 43.119999999999997 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.239999999999995 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.492 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.209999999999994 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 71.209999999999994 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.019999999999996 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.510000000000005 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 70.140000000000001 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.010000000000005 109.439 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.040000000000006 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 63.240000000000002 112.137 -146.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.239999999999995 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.010000000000005 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 74.439999999999998 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.209999999999994 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.423 HD23 ' H ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -64.43 -153.63 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.120000000000005 111.624 173.264 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.304 0.8 OUTLIER -94.49 -70.51 0.7 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.807 1.781 . . . . 71.430000000000007 115.807 166.497 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -68.56 104.98 2.09 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 124.076 1.893 . . . . 74.109999999999999 111.567 -169.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.56 156.7 28.52 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 111.834 -2.439 . . . . 74.209999999999994 107.063 177.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.02 -25.48 2.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.666 -0.683 . . . . 73.140000000000001 112.49 165.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 t -68.93 -33.95 74.57 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 123.334 0.396 . . . . 75.230000000000004 110.555 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.1 m -107.45 -28.82 9.59 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.231 1.197 . . . . 71.299999999999997 114.231 -162.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.89 11.64 20.28 Favored Glycine 0 C--N 1.34 0.759 0 C-N-CA 123.797 0.713 . . . . 74.319999999999993 113.088 167.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -73.32 -174.76 1.7 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 117.348 0.574 . . . . 73.239999999999995 111.449 -173.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 77.64 97.01 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 129.376 3.07 . . . . 71.439999999999998 113.51 -172.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -137.87 -3.77 1.81 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.423 1.889 . . . . 75.099999999999994 114.426 171.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.219999999999999 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.219999999999999 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 64.099999999999994 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 75.420000000000002 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.340000000000003 107.464 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.409999999999997 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 74.319999999999993 109.604 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.239999999999995 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.439999999999998 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.25 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.340000000000003 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 73.439999999999998 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.420000000000002 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.340000000000003 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . 0.492 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 71.329999999999998 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.349999999999994 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.209999999999994 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 73.409999999999997 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.450000000000003 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.109999999999999 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 72.349999999999994 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 65.25 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 61.240000000000002 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.349999999999994 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 55.240000000000002 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 63.109999999999999 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.540000000000006 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 75.349999999999994 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 75.140000000000001 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.329999999999998 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 64.310000000000002 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.239999999999995 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.420000000000002 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 54.87 1.73 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.140000000000001 112.752 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.68 156.69 4.45 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 123.759 0.824 . . . . 51.350000000000001 111.068 177.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.1 -24.83 14.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.761 2.308 . . . . 72.099999999999994 114.209 -161.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -158.48 162.22 27.12 Favored Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 126.43 1.892 . . . . 72.439999999999998 108.69 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.28 105.21 1.53 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.471 2.114 . . . . 73.140000000000001 107.562 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -120.38 55.91 1.0 Allowed 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.89 1.276 . . . . 74.030000000000001 110.814 -169.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.34 155.51 3.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.672 1.989 . . . . 74.129999999999995 107.737 171.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -71.26 137.3 48.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 106.352 -1.722 . . . . 73.120000000000005 106.352 159.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 45.32 56.07 5.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.291 1.519 . . . . 72.420000000000002 113.902 156.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.85 -3.32 9.25 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.065 1.746 . . . . 41.200000000000003 112.92 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -119.23 6.42 11.22 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.599 1.96 . . . . 73.099999999999994 111.9 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.251 1.137 0 N-CA-C 106.543 -1.651 . . . . 74.420000000000002 106.543 171.305 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 108.56 -0.904 . . . . 53.219999999999999 108.56 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.79 18.43 6.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.352 0.978 . . . . 74.129999999999995 112.51 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.319999999999993 105.884 -176.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 74.420000000000002 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.340000000000003 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.409999999999997 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.120000000000005 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.299999999999997 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.010000000000005 111.236 -175.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.430000000000007 112.406 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 75.450000000000003 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.519999999999996 114.188 -170.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 73.140000000000001 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 75.340000000000003 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.200000000000003 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 73.540000000000006 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.540000000000006 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 75.219999999999999 109.416 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 75.530000000000001 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.32 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.519999999999996 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.109999999999999 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.319999999999993 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.219999999999999 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.340000000000003 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 63.520000000000003 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 74.200000000000003 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.530000000000001 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.099999999999994 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.299999999999997 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.439999999999998 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 74.430000000000007 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.049999999999997 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.427 HD21 ' H ' ' A' ' 35' ' ' MET . 1.3 tm? -76.39 163.21 27.19 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.299999999999997 109.638 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.427 ' H ' HD21 ' A' ' 34' ' ' LEU . 20.6 mtp -59.4 14.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 129.724 3.209 . . . . 72.049999999999997 116.046 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -139.94 132.76 29.15 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 126.045 1.738 . . . . 75.420000000000002 108.332 171.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -162.58 -47.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.152 0.981 . . . . 75.219999999999999 113.326 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.08 7.35 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 118.347 2.721 . . . . 75.439999999999998 118.347 -169.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -121.41 -16.89 7.74 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 127.889 2.476 . . . . 74.420000000000002 111.634 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.8 t -126.7 -31.54 2.69 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.159 1.345 . . . . 61.420000000000002 113.539 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.88 21.25 12.37 Favored Glycine 0 N--CA 1.473 1.134 0 CA-C-N 119.057 0.844 . . . . 75.420000000000002 112.875 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -67.8 118.92 11.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.813 1.245 . . . . 75.040000000000006 108.377 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p 174.76 141.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 129.667 3.187 . . . . 61.32 106.523 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 173.86 0.37 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.441 2.696 . . . . 73.219999999999999 115.026 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.120000000000005 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.420000000000002 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.409999999999997 109.247 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 73.239999999999995 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 73.400000000000006 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 73.010000000000005 113.14 164.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.230000000000004 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.340000000000003 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.209999999999994 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 73.120000000000005 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 70.019999999999996 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.340000000000003 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.200000000000003 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.310000000000002 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.319999999999993 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.109999999999999 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.230000000000004 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.229999999999997 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.230000000000004 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 61.439999999999998 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.340000000000003 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 72.409999999999997 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.540000000000006 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.439999999999998 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.340000000000003 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.299999999999997 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.299999999999997 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 63.210000000000001 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.420000000000002 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.099999999999994 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 72.310000000000002 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.409999999999997 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.439999999999998 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.420000000000002 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.98 84.21 1.25 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.340000000000003 108.469 158.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.82 156.96 91.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 O-C-N 120.686 -1.259 . . . . 71.209999999999994 112.47 -175.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -68.57 -46.44 1.89 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.744 1.629 . . . . 65.230000000000004 113.966 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -160.6 154.24 18.87 Favored Pre-proline 0 C--O 1.238 0.478 0 N-CA-C 105.342 -2.096 . . . . 72.109999999999999 105.342 165.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.56 101.29 0.2 Allowed 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.056 2.504 . . . . 74.340000000000003 110.134 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -100.24 17.48 21.23 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.029 1.332 . . . . 72.099999999999994 111.363 -177.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.68 166.4 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 125.301 1.441 . . . . 63.32 107.715 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -58.24 -176.25 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.861 1.264 . . . . 71.439999999999998 109.846 165.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.17 112.63 0.43 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.784 2.434 . . . . 74.420000000000002 109.097 177.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -68.38 -9.17 46.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.326 0.65 . . . . 64.129999999999995 112.417 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 32.4 p-90 -117.03 5.9 12.87 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 127.187 2.195 . . . . 72.299999999999997 110.823 -170.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.253 1.285 0 N-CA-C 104.608 -2.367 . . . . 74.310000000000002 104.608 162.737 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 109.014 -0.736 . . . . 74.329999999999998 109.014 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -132.19 -4.76 3.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.871 1.214 . . . . 74.310000000000002 112.001 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.519999999999996 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 75.239999999999995 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.400000000000006 109.861 166.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.120000000000005 108.548 -168.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 73.430000000000007 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.530000000000001 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.409999999999997 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.319999999999993 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 75.409999999999997 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 75.349999999999994 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.209999999999994 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.140000000000001 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.140000000000001 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.209999999999994 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 71.409999999999997 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.420000000000002 110.126 173.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.409999999999997 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 71.140000000000001 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.530000000000001 108.26 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 61.229999999999997 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 72.109999999999999 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.519999999999996 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.239999999999995 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.41 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 74.420000000000002 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.319999999999993 115.227 -165.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.409999999999997 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.400000000000006 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.109999999999999 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.209999999999994 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.613 ' CD2' ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -107.65 -172.47 2.08 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.420000000000002 113.333 -175.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.613 ' H ' ' CD2' ' A' ' 34' ' ' LEU . 70.6 mtp -67.7 -9.98 48.4 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.22 1.933 . . . . 72.299999999999997 116.22 -162.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -44.07 -58.03 3.05 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.965 2.106 . . . . 75.299999999999997 111.053 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -74.66 70.72 1.86 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 126.422 1.889 . . . . 60.130000000000003 113.525 -163.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 -0.07 5.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 120.368 -1.458 . . . . 75.129999999999995 114.107 -166.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 m -104.34 -45.4 4.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.875 0.762 . . . . 75.409999999999997 109.78 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.2 t -58.73 -33.36 70.14 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.432 1.014 . . . . 64.420000000000002 110.885 174.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.62 51.99 3.68 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 107.903 -2.079 . . . . 71.310000000000002 107.903 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -90.29 22.61 3.26 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.097 -1.075 . . . . 73.239999999999995 108.097 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.402 ' HB3' ' HA ' ' A' ' 35' ' ' MET . 7.5 p -136.02 94.92 3.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.912 2.085 . . . . 75.219999999999999 111.036 -163.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.66 -71.36 0.59 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 127.441 2.296 . . . . 71.120000000000005 108.242 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.319999999999993 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 72.200000000000003 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.420000000000002 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.120000000000005 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.540000000000006 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.319999999999993 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.430000000000007 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 73.140000000000001 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.510000000000005 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 73.319999999999993 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 74.200000000000003 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 71.430000000000007 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 74.200000000000003 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 72.400000000000006 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 75.329999999999998 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.150000000000006 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.310000000000002 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.129999999999995 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.209999999999994 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.319999999999993 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 73.540000000000006 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 74.439999999999998 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.319999999999993 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 73.549999999999997 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.439999999999998 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.129999999999995 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.319999999999993 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.549999999999997 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.549999999999997 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.409999999999997 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.150000000000006 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.549999999999997 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.539999999999999 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 73.140000000000001 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 74.5 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -129.01 54.53 1.79 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.219999999999999 106.984 176.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.43 154.96 61.29 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 111.721 0.267 . . . . 72.420000000000002 111.721 -167.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.09 -18.88 23.51 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.763 0.976 . . . . 75.540000000000006 114.212 -166.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 pttt 59.11 166.17 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 128.345 2.658 . . . . 71.400000000000006 113.364 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.62 105.67 0.95 Allowed 'Trans proline' 0 N--CA 1.447 -1.227 0 N-CA-C 106.889 -2.004 . . . . 73.319999999999993 106.889 161.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -118.17 24.04 11.22 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 122.19 0.995 . . . . 75.340000000000003 109.788 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.87 154.0 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 105.835 -1.913 . . . . 75.040000000000006 105.835 166.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -74.06 -5.88 44.21 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.827 1.047 . . . . 71.230000000000004 113.827 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -136.96 113.13 9.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 107.537 -1.282 . . . . 64.200000000000003 107.537 -171.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 1.64 41.41 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.692 -1.594 . . . . 71.420000000000002 111.99 -176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -129.59 0.24 4.96 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.849 2.06 . . . . 73.099999999999994 112.208 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--O 1.254 1.316 0 C-N-CA 123.9 0.88 . . . . 73.239999999999995 108.882 170.736 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 109.395 -0.594 . . . . 72.329999999999998 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -144.9 26.72 1.35 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.669 1.987 . . . . 74.549999999999997 108.636 -176.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 75.549999999999997 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 75.340000000000003 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.420000000000002 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 75.310000000000002 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 74.239999999999995 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.349999999999994 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 62.130000000000003 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.510000000000005 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.109999999999999 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.510000000000005 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.120000000000005 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.430000000000007 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.549999999999997 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 72.310000000000002 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 74.219999999999999 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.340000000000003 107.017 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.329999999999998 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.109999999999999 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 73.430000000000007 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 75.340000000000003 109.068 -177.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 64.109999999999999 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 72.530000000000001 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' CE1' HD22 ' A' ' 64' ' ' ASN . 91.5 m-70 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.129999999999995 112.971 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 71.439999999999998 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.473 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 72.510000000000005 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.540000000000006 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.540000000000006 109.937 -157.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.409999999999997 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 74.319999999999993 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 73.409999999999997 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.140000000000001 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.507 ' CD2' ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -129.71 -154.48 0.64 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 63.25 108.261 175.573 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.507 ' H ' ' CD2' ' A' ' 34' ' ' LEU . 5.7 mtp -68.94 69.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 129.002 2.921 . . . . 74.540000000000006 114.05 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -143.63 -35.12 0.39 Allowed 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 118.545 -0.741 . . . . 75.540000000000006 111.764 -164.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.495 ' C ' ' H ' ' A' ' 39' ' ' SER . 10.6 t-20 -77.12 -45.69 26.05 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 119.834 1.197 . . . . 73.340000000000003 108.586 -172.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 47.06 -7.74 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 1 C-N-CA 132.296 4.238 . . . . 74.109999999999999 115.962 -154.095 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.495 ' H ' ' C ' ' A' ' 37' ' ' ASN . 0.4 OUTLIER -98.78 -17.18 18.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 118.248 -0.882 . . . . 75.549999999999997 112.897 -165.415 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.5 t -131.27 -26.74 2.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.73 1.15 . . . . 75.109999999999999 113.311 -162.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.73 -2.71 2.22 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 115.732 1.053 . . . . 63.539999999999999 115.732 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -75.42 11.03 1.36 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.228 1.514 . . . . 74.219999999999999 114.151 -160.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.49 ' HB3' ' HA ' ' A' ' 35' ' ' MET . 3.6 p -131.88 105.41 7.43 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 125.389 1.476 . . . . 75.450000000000003 111.338 -173.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -153.52 9.69 0.41 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 73.319999999999993 114.351 175.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.149999999999999 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 75.319999999999993 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.130000000000003 110.517 -177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 75.540000000000006 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 75.409999999999997 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.349999999999994 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.473 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.230000000000004 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.409999999999997 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 75.239999999999995 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.329999999999998 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.409999999999997 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.340000000000003 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.430000000000007 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 75.439999999999998 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.230000000000004 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.539999999999999 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.230000000000004 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 71.25 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 63.409999999999997 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.407 HD22 ' CE1' ' A' ' 25' ' ' HIS . 70.2 m-80 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.329999999999998 111.355 -176.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 74.239999999999995 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 74.510000000000005 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.530000000000001 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.219999999999999 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.450000000000003 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 75.409999999999997 106.392 -166.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 75.25 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.219999999999999 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.209999999999994 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 72.150000000000006 106.688 168.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.549999999999997 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 75.540000000000006 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.439999999999998 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.530000000000001 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.32 72.3 10.36 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 74.519999999999996 106.127 163.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.26 144.61 69.91 Favored Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 121.206 -0.934 . . . . 73.140000000000001 111.053 -171.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.69 -22.74 20.25 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.922 1.748 . . . . 73.349999999999994 112.982 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.272 11.2 ptpt 54.27 163.91 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 131.224 3.809 . . . . 71.340000000000003 114.451 -172.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.52 100.82 0.5 Allowed 'Trans proline' 0 N--CA 1.443 -1.452 0 N-CA-C 107.438 -1.793 . . . . 55.329999999999998 107.438 158.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.94 22.43 13.94 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.138 1.375 . . . . 73.129999999999995 108.312 173.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.9 mp -64.29 137.17 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 N-CA-C 104.34 -2.467 . . . . 64.450000000000003 104.34 160.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.02 -3.11 20.96 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.524 0.935 . . . . 74.230000000000004 113.524 -178.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -136.21 168.02 20.18 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.445 1.898 . . . . 64.439999999999998 109.33 175.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.81 -1.52 7.27 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.849 0.859 . . . . 75.150000000000006 112.581 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -111.56 5.44 19.43 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.02 2.128 . . . . 73.450000000000003 111.381 171.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.249 1.034 0 C-N-CA 124.174 0.989 . . . . 75.439999999999998 109.909 172.792 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.9 t . . . . . 0 CA--C 1.514 -0.409 0 CA-C-O 122.323 1.059 . . . . 40.32 108.944 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -137.06 1.02 2.43 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 130.03 3.332 . . . . 74.329999999999998 108.135 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 64.400000000000006 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 73.010000000000005 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 75.209999999999994 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 74.420000000000002 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.420000000000002 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.430000000000007 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.030000000000001 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 64.140000000000001 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 62.020000000000003 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.310000000000002 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.109999999999999 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.409999999999997 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.140000000000001 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 73.340000000000003 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.219999999999999 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.458 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 73.239999999999995 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 75.140000000000001 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 75.140000000000001 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 73.329999999999998 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.219999999999999 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 74.040000000000006 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 74.150000000000006 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.030000000000001 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.019999999999996 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.040000000000006 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.420000000000002 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 75.109999999999999 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.129999999999995 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.120000000000005 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.349999999999994 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.481 HD13 ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -111.5 -153.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.150000000000006 106.352 166.023 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.481 ' H ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER 55.13 -176.49 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.236 1 C-N-CA 132.133 4.173 . . . . 75.430000000000007 110.222 -169.043 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.8 140.08 29.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 106.799 -1.556 . . . . 74.439999999999998 106.799 168.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -161.12 98.03 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.668 0.387 . . . . 75.040000000000006 111.35 170.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -11.5 40.96 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.894 1.442 . . . . 73.430000000000007 114.894 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -93.06 -13.63 28.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.497 1.119 . . . . 64.219999999999999 111.139 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -123.6 -42.04 2.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 120.363 1.438 . . . . 55.539999999999999 112.164 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.38 16.09 3.95 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 123.813 0.72 . . . . 72.430000000000007 113.303 172.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -85.71 173.72 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 117.96 0.88 . . . . 75.150000000000006 109.712 -173.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.0 p 75.33 88.45 0.09 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 130.807 3.643 . . . . 72.209999999999994 110.42 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -132.86 -0.48 3.43 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.547 -0.752 . . . . 74.209999999999994 112.118 -173.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.210000000000001 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.150000000000006 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.239999999999995 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.209999999999994 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 75.319999999999993 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.319999999999993 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.209999999999994 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.239999999999995 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 64.299999999999997 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 64.099999999999994 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.430000000000007 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.450000000000003 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 62.229999999999997 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.049999999999997 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.420000000000002 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.329999999999998 111.454 176.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.430000000000007 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.420000000000002 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 63.329999999999998 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.450000000000003 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 71.140000000000001 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.430000000000007 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 73.230000000000004 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 74.25 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.049999999999997 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 72.430000000000007 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 74.430000000000007 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 73.349999999999994 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 73.349999999999994 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 71.329999999999998 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 75.329999999999998 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 72.329999999999998 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.409999999999997 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 72.239999999999995 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.150000000000006 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.65 60.04 5.86 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 71.019999999999996 108.024 172.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.7 153.91 38.86 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.191 0.996 . . . . 75.299999999999997 111.565 -172.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -72.6 -40.72 1.94 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.887 1.725 . . . . 64.209999999999994 111.824 -164.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -159.34 146.12 12.61 Favored Pre-proline 0 N--CA 1.444 -0.734 0 C-N-CA 126.991 2.117 . . . . 71.400000000000006 106.567 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.99 105.34 0.66 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 C-N-CA 123.145 2.563 . . . . 74.030000000000001 107.617 175.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -118.84 43.84 2.45 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.281 1.832 . . . . 75.140000000000001 111.235 -167.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.498 HD13 ' H ' ' A' ' 86' ' ' ILE . 1.5 mp -57.36 156.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 106.872 -1.529 . . . . 75.400000000000006 106.872 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -64.68 -154.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.564 1.145 . . . . 72.019999999999996 108.224 162.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -57.88 132.56 53.75 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 119.97 -1.706 . . . . 75.400000000000006 109.344 173.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.23 -3.08 5.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.856 -0.611 . . . . 74.209999999999994 110.704 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.1 p-90 -128.84 -5.51 5.1 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.421 1.088 . . . . 75.200000000000003 112.887 -174.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.559 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 113.222 0.823 . . . . 74.430000000000007 113.222 168.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.774 -0.454 . . . . 70.150000000000006 109.774 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -126.07 12.57 7.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.392 2.277 . . . . 73.319999999999993 111.461 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 74.329999999999998 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 71.120000000000005 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.439999999999998 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 72.409999999999997 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.409999999999997 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.230000000000004 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.420000000000002 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.400000000000006 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.239999999999995 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.030000000000001 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.349999999999994 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.010000000000005 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.439999999999998 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.420000000000002 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.319999999999993 110.744 176.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 74.299999999999997 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.299999999999997 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 75.019999999999996 109.813 172.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 75.329999999999998 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.519999999999996 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.541 ' CE1' HD22 ' A' ' 64' ' ' ASN . 38.4 m-70 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.140000000000001 111.423 176.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.129999999999995 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.030000000000001 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.230000000000004 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.420000000000002 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.349999999999994 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 72.329999999999998 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 75.209999999999994 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.655 ' CD1' ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -71.7 -154.17 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 73.219999999999999 109.341 171.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.655 ' H ' ' CD1' ' A' ' 34' ' ' LEU . 1.4 mtm -94.9 -164.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 127.421 2.288 . . . . 71.019999999999996 105.863 168.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtp85 68.84 -5.04 1.06 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 127.562 2.345 . . . . 75.040000000000006 116.736 167.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.73 -26.72 63.51 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.672 0.99 . . . . 75.230000000000004 113.672 -161.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 47.29 -15.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 129.897 3.279 . . . . 53.409999999999997 118.459 -169.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.3 p -103.92 -6.25 21.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 120.028 1.285 . . . . 75.129999999999995 113.702 -167.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 p -146.92 -7.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.778 1.399 . . . . 74.140000000000001 114.778 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.42 27.91 37.97 Favored Glycine 0 C--N 1.337 0.618 0 O-C-N 120.25 -1.531 . . . . 64.239999999999995 110.861 168.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -60.27 -173.3 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.154 1.782 . . . . 73.230000000000004 109.427 164.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 p 77.03 137.31 0.06 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.749 2.42 . . . . 72.219999999999999 111.926 -167.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -167.98 15.98 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.71 2.404 . . . . 75.209999999999994 111.988 165.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.109999999999999 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.150000000000006 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 74.209999999999994 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.109999999999999 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 74.239999999999995 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.349999999999994 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 74.109999999999999 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 72.150000000000006 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.329999999999998 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.409999999999997 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.450000000000003 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.230000000000004 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.129999999999995 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.239999999999995 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.239999999999995 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.010000000000005 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.230000000000004 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.010000000000005 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.541 HD22 ' CE1' ' A' ' 25' ' ' HIS . 65.8 m-80 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.439999999999998 110.778 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.239999999999995 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 23.7 m170 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 74.510000000000005 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.099999999999994 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 72.319999999999993 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 74.400000000000006 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.420000000000002 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 63.530000000000001 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.299999999999997 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.120000000000005 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 74.519999999999996 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 73.299999999999997 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.340000000000003 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 75.239999999999995 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 74.030000000000001 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.230000000000004 106.521 162.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -128.99 52.26 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.409999999999997 107.689 -172.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.31 154.41 8.35 Favored Pre-proline 0 C--O 1.233 0.222 0 C-N-CA 123.9 0.88 . . . . 74.430000000000007 112.232 -165.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -69.93 -28.66 24.16 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 120.044 0.496 . . . . 75.319999999999993 113.123 -172.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.266 12.7 ptpt 54.79 164.47 0.05 OUTLIER Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 131.32 3.848 . . . . 74.450000000000003 113.334 -175.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -67.76 106.03 1.22 Allowed 'Trans proline' 0 N--CA 1.443 -1.491 0 N-CA-C 106.987 -1.966 . . . . 73.109999999999999 106.987 164.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -105.37 14.27 29.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.021 1.329 . . . . 75.230000000000004 111.414 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.416 HD11 ' H ' ' A' ' 86' ' ' ILE . 3.7 mp -67.28 147.45 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 122.297 1.046 . . . . 75.040000000000006 108.531 -169.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -5.07 26.88 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.745 1.017 . . . . 75.129999999999995 113.745 172.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -134.41 90.98 2.73 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 129.665 3.186 . . . . 75.239999999999995 104.758 -174.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.93 -10.21 31.79 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.726 -0.608 . . . . 75.439999999999998 112.165 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -123.32 6.44 9.06 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.69 1.996 . . . . 74.120000000000005 112.662 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.246 0.892 0 N-CA-C 106.839 -1.541 . . . . 74.209999999999994 106.839 169.86 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.466 0.335 0 N-CA-C 108.076 -1.083 . . . . 72.319999999999993 108.076 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -125.22 9.21 7.95 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 74.200000000000003 111.412 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 65.219999999999999 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.099999999999994 115.764 172.695 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 73.010000000000005 108.58 167.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 73.439999999999998 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.209999999999994 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 63.149999999999999 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HB3' HE22 ' A' ' 73' ' ' GLN . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.350000000000001 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.439999999999998 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 74.040000000000006 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 53.229999999999997 112.57 -170.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 74.150000000000006 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.430000000000007 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.420000000000002 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 74.25 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 74.349999999999994 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 53.420000000000002 111.055 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.430000000000007 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.340000000000003 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 74.099999999999994 109.809 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 71.010000000000005 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.219999999999999 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 62.020000000000003 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.140000000000001 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 73.340000000000003 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.230000000000004 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 53.109999999999999 112.892 -164.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 74.219999999999999 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 72.099999999999994 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.409999999999997 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.43 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.586 HD13 ' H ' ' A' ' 35' ' ' MET . 0.2 OUTLIER -77.29 -174.48 3.28 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 74.409999999999997 110.813 -179.084 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.586 ' H ' HD13 ' A' ' 34' ' ' LEU . 3.0 ttp -88.4 -0.87 57.66 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.823 2.049 . . . . 74.140000000000001 112.269 -174.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mtp85 -119.26 113.15 20.41 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 104.959 -2.237 . . . . 74.010000000000005 104.959 171.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -166.45 87.12 0.33 Allowed 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.97 0.908 . . . . 70.409999999999997 110.947 175.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -28.33 23.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.572 0.952 . . . . 74.200000000000003 113.572 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -89.53 2.99 53.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.473 0.916 . . . . 74.120000000000005 113.473 -174.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.9 t -152.64 -14.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.658 1.572 . . . . 72.209999999999994 112.446 -176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.68 77.54 Favored Glycine 0 C--N 1.342 0.914 0 O-C-N 119.722 -1.861 . . . . 73.099999999999994 110.86 170.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -63.32 114.63 3.95 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 126.448 1.899 . . . . 71.040000000000006 108.149 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.8 t 178.49 145.15 0.13 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 128.803 2.841 . . . . 70.230000000000004 108.062 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 174.88 -42.5 0.01 OUTLIER 'General case' 0 C--N 1.346 0.417 0 C-N-CA 127.658 2.383 . . . . 71.340000000000003 111.622 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 70.040000000000006 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 65.310000000000002 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 64.0 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.430000000000007 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 61.020000000000003 106.981 168.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.230000000000004 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 63.0 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 73.420000000000002 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.430000000000007 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.219999999999999 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.030000000000001 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.340000000000003 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 64.030000000000001 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.340000000000003 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 71.019999999999996 113.543 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.099999999999994 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.430000000000007 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.019999999999996 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 73.420000000000002 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 71.409999999999997 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.400000000000006 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 72.319999999999993 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.049999999999997 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.319999999999993 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 72.120000000000005 108.541 -177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 73.209999999999994 111.689 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.310000000000002 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.472 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.150000000000006 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 75.209999999999994 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 72.140000000000001 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.430000000000007 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 62.020000000000003 110.078 165.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 72.420000000000002 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 74.019999999999996 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t -88.97 63.95 6.95 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.430000000000007 108.125 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.4 p-10 -61.44 149.66 82.91 Favored Pre-proline 0 CA--C 1.541 0.618 0 O-C-N 121.705 -0.622 . . . . 63.229999999999997 110.645 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -67.71 -55.06 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.689 2.259 . . . . 74.319999999999993 110.034 -172.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -122.13 153.02 61.11 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 125.021 1.328 . . . . 72.099999999999994 108.081 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.73 106.67 0.95 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 122.697 2.265 . . . . 71.030000000000001 108.881 168.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -104.76 20.26 19.0 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.481 -0.762 . . . . 74.329999999999998 112.664 167.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.6 mp -66.58 165.27 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 107.476 -1.305 . . . . 74.010000000000005 107.476 171.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -102.04 146.79 27.4 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.801 2.04 . . . . 75.140000000000001 106.861 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 44.37 64.71 1.23 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 127.32 2.248 . . . . 73.019999999999996 111.248 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.09 -28.27 39.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.626 -1.17 . . . . 75.409999999999997 111.402 -178.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 27.6 p-90 -95.94 -5.45 41.34 Favored 'General case' 0 CA--C 1.521 -0.153 0 N-CA-C 113.452 0.908 . . . . 75.400000000000006 113.452 -173.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.244 0.813 0 N-CA-C 107.442 -1.318 . . . . 74.420000000000002 107.442 179.498 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 N--CA 1.472 0.663 0 CA-C-O 121.082 0.467 . . . . 64.450000000000003 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -151.53 12.85 0.63 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.878 1.671 . . . . 74.430000000000007 111.649 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.340000000000003 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.319999999999993 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.439999999999998 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.120000000000005 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.239999999999995 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.430000000000007 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.400000000000006 108.453 167.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.219999999999999 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 74.310000000000002 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 75.120000000000005 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 72.310000000000002 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 75.329999999999998 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.409999999999997 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.120000000000005 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 75.319999999999993 107.56 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 74.030000000000001 110.313 -174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 75.439999999999998 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 74.200000000000003 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 74.030000000000001 108.108 172.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.329999999999998 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.209999999999994 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 70.099999999999994 107.361 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.230000000000004 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.452 ' CG1' ' CE2' ' A' ' 51' ' ' PHE . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 71.299999999999997 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.120000000000005 113.776 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 75.239999999999995 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.129999999999995 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.430000000000007 108.25 173.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.129999999999995 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD21 ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -76.85 -170.06 1.49 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.120000000000005 110.408 -176.226 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.495 ' H ' HD21 ' A' ' 34' ' ' LEU . 1.1 mtp -75.57 147.05 39.96 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 120.692 -1.255 . . . . 75.109999999999999 108.284 164.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 66.02 135.78 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.999 1.72 . . . . 75.420000000000002 110.787 -172.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -165.97 -42.76 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 113.376 -1.738 . . . . 73.030000000000001 111.459 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 55.42 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 1 C-N-CA 131.912 4.085 . . . . 75.040000000000006 117.269 -166.914 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.17 -44.66 12.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 124.402 1.081 . . . . 74.439999999999998 110.247 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.6 m -115.18 -2.74 12.65 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.459 1.281 . . . . 75.030000000000001 114.459 177.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.08 8.21 75.88 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.997 1.271 . . . . 61.329999999999998 112.123 161.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -56.71 127.1 29.85 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 128.156 2.582 . . . . 74.409999999999997 109.875 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 89.4 p -173.1 179.57 2.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.435 2.294 . . . . 74.530000000000001 111.418 161.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 174.73 -35.01 0.0 OUTLIER 'General case' 0 C--N 1.345 0.407 0 C-N-CA 129.619 3.167 . . . . 74.200000000000003 111.481 166.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.340000000000003 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 73.299999999999997 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 73.140000000000001 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.209999999999994 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 64.299999999999997 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 74.239999999999995 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 73.540000000000006 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.549999999999997 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.019999999999996 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.349999999999994 113.542 -176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.340000000000003 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.119999999999997 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.129999999999995 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 72.340000000000003 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 74.329999999999998 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.209999999999994 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.420000000000002 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.540000000000006 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 70.129999999999995 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.239999999999995 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.299999999999997 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 74.299999999999997 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.140000000000001 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 64.319999999999993 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 71.200000000000003 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 73.400000000000006 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 74.319999999999993 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.439999999999998 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.129999999999995 108.253 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 73.209999999999994 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.400000000000006 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 71.430000000000007 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.129999999999995 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 73.430000000000007 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.59 77.59 0.18 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.140000000000001 105.516 153.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.28 161.9 37.44 Favored Pre-proline 0 CA--C 1.541 0.624 0 O-C-N 120.998 -1.064 . . . . 74.150000000000006 109.108 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.17 -33.58 3.41 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 CA-C-N 120.372 1.169 . . . . 54.130000000000003 113.129 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.29 14.3 ptpt 54.43 165.95 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 129.526 3.13 . . . . 65.310000000000002 113.876 -170.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -65.94 105.6 0.84 Allowed 'Trans proline' 0 N--CA 1.445 -1.327 0 N-CA-C 106.458 -2.17 . . . . 73.120000000000005 106.458 159.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -114.0 17.22 17.99 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.745 1.218 . . . . 74.010000000000005 112.717 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -78.83 165.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 125.955 1.702 . . . . 72.310000000000002 108.872 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.43 -6.03 9.28 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.88 1.067 . . . . 71.25 113.88 162.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -120.09 103.13 9.02 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 126.686 1.994 . . . . 72.319999999999993 107.183 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.62 -6.12 9.71 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.266 1.427 . . . . 64.040000000000006 110.9 -174.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 33.8 p-90 -136.42 10.11 3.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.972 2.109 . . . . 74.430000000000007 110.719 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.068 1.747 . . . . 71.150000000000006 108.597 176.462 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 121.852 0.834 . . . . 64.450000000000003 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -135.16 12.88 3.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 128.399 2.68 . . . . 72.010000000000005 110.003 163.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.329999999999998 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.120000000000005 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 73.420000000000002 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 73.310000000000002 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.430000000000007 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.119999999999997 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 61.409999999999997 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.140000000000001 110.749 173.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.239999999999995 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 73.510000000000005 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.310000000000002 111.669 -167.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.430000000000007 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.420000000000002 110.348 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 71.340000000000003 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.439999999999998 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.109999999999999 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.120000000000005 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 52.539999999999999 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 75.439999999999998 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 71.430000000000007 109.365 168.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.329999999999998 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.109999999999999 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.219999999999999 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 62.310000000000002 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 74.209999999999994 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.150000000000006 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 74.329999999999998 109.168 152.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.420000000000002 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.299999999999997 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 63.43 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.140000000000001 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' CG ' ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -131.71 -153.39 0.55 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.030000000000001 106.983 169.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.46 ' H ' ' CG ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER 57.05 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.75 1 C-N-CA 132.34 4.256 . . . . 74.430000000000007 110.346 -165.901 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 172.9 155.62 0.1 Allowed 'General case' 0 CA--C 1.502 -0.903 0 C-N-CA 127.1 2.16 . . . . 75.109999999999999 106.942 -167.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -164.84 -2.2 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.567 1.321 . . . . 74.310000000000002 114.567 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.18 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 119.049 2.981 . . . . 72.439999999999998 119.049 -165.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.6 p -89.82 -29.59 18.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 121.506 1.957 . . . . 73.400000000000006 113.918 -165.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.3 t -123.72 -43.83 2.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.249 0.833 . . . . 71.230000000000004 113.249 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.55 24.47 0.13 Allowed Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.373 -1.237 . . . . 52.32 114.885 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -65.63 8.15 0.19 Allowed 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 120.201 2.0 . . . . 64.209999999999994 115.179 -170.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 78.1 p -148.26 93.54 2.18 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 120.524 -1.36 . . . . 72.400000000000006 112.713 -173.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -132.62 20.83 4.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.532 0.733 . . . . 74.530000000000001 112.082 174.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.430000000000007 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 62.409999999999997 110.254 -163.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.329999999999998 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 62.420000000000002 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 72.409999999999997 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.140000000000001 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.049999999999997 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.420000000000002 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.049999999999997 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.120000000000005 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.109999999999999 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.319999999999993 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 72.030000000000001 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.450000000000003 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.439999999999998 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.340000000000003 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.310000000000002 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.150000000000006 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 74.140000000000001 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 73.519999999999996 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.120000000000005 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.120000000000005 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.120000000000005 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 74.430000000000007 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.140000000000001 106.618 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.430000000000007 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 72.549999999999997 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 73.25 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 75.439999999999998 106.327 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 72.239999999999995 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.420000000000002 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.540000000000006 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 75.530000000000001 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.26 50.27 0.86 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.439999999999998 110.298 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -48.66 146.68 4.92 Favored Pre-proline 0 N--CA 1.467 0.392 0 C-N-CA 124.61 1.164 . . . . 73.230000000000004 112.666 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.21 -32.54 8.26 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.834 1.689 . . . . 74.420000000000002 112.935 -167.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -156.4 162.47 27.44 Favored Pre-proline 0 C--O 1.235 0.328 0 C-N-CA 125.295 1.438 . . . . 74.010000000000005 109.402 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.46 91.87 0.86 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.141 2.561 . . . . 73.010000000000005 110.245 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -106.97 44.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 O-C-N 120.522 -1.361 . . . . 73.400000000000006 110.142 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.44 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -69.61 154.05 8.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 106.3 -1.741 . . . . 74.129999999999995 106.3 162.785 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -59.38 133.19 55.87 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 107.36 -1.348 . . . . 63.25 107.36 159.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.485 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 1.9 mp0 43.63 58.03 3.71 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 126.859 2.064 . . . . 72.409999999999997 113.343 155.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.02 -5.28 16.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.426 2.29 . . . . 74.239999999999995 112.979 -175.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 66.4 p-90 -126.98 8.8 6.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.528 1.531 . . . . 73.329999999999998 112.682 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 C--O 1.247 0.934 0 N-CA-C 106.425 -1.694 . . . . 73.120000000000005 106.425 170.759 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.465 0.289 0 N-CA-C 108.743 -0.836 . . . . 70.319999999999993 108.743 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -134.68 21.64 3.6 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.449 1.1 . . . . 70.109999999999999 111.928 178.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.540000000000006 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.239999999999995 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.450000000000003 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.239999999999995 110.569 -177.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 73.420000000000002 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.219999999999999 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.510000000000005 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.450000000000003 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.129999999999995 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.409999999999997 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 64.129999999999995 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.510000000000005 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 75.310000000000002 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.239999999999995 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 75.209999999999994 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 75.310000000000002 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 71.450000000000003 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.140000000000001 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.400000000000006 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 73.329999999999998 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.420000000000002 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.530000000000001 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 74.219999999999999 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.530000000000001 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.519999999999996 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.430000000000007 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 72.549999999999997 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 72.530000000000001 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 74.150000000000006 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -131.75 124.74 30.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.41 ' HG3' ' H ' ' A' ' 36' ' ' ARG . 7.1 ptm -169.11 -87.05 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.958 1.708 . . . . 73.409999999999997 113.882 155.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.41 ' H ' ' HG3' ' A' ' 35' ' ' MET . 19.7 mmt85 -153.92 -55.58 0.11 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.809 1.644 . . . . 73.549999999999997 110.21 -174.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 59.71 -33.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 1 C-N-CA 132.099 4.16 . . . . 73.230000000000004 117.653 174.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.368 0.0 OUTLIER 46.22 -70.4 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 126.525 1.93 . . . . 75.219999999999999 115.671 -141.085 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.22 -65.27 0.59 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 126.254 1.822 . . . . 75.310000000000002 113.346 -164.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.51 -39.39 77.58 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.528 -0.732 . . . . 73.439999999999998 111.114 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.03 57.68 2.63 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 107.067 -2.413 . . . . 74.430000000000007 107.067 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -78.73 29.8 0.2 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.208 1.803 . . . . 75.430000000000007 110.689 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.1 p -163.76 9.71 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.779 1.029 . . . . 75.530000000000001 113.779 -160.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -76.9 -6.78 53.83 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.239 -0.913 . . . . 74.140000000000001 111.732 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.219999999999999 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 75.319999999999993 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 61.530000000000001 110.565 165.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.120000000000005 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 62.340000000000003 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.510000000000005 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 64.329999999999998 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.5 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 72.340000000000003 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 72.219999999999999 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.120000000000005 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.219999999999999 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.219999999999999 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.120000000000005 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.219999999999999 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.109999999999999 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 73.200000000000003 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 72.310000000000002 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 71.120000000000005 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.439999999999998 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 72.420000000000002 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 65.140000000000001 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 45.240000000000002 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.409999999999997 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.319999999999993 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 74.209999999999994 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.230000000000004 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.43 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.030000000000001 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.540000000000006 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.530000000000001 105.978 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.030000000000001 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.120000000000005 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.239999999999995 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.439999999999998 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t -90.96 51.63 2.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.340000000000003 109.469 176.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 p30 -56.03 159.12 6.07 Favored Pre-proline 0 CA--C 1.537 0.48 0 O-C-N 122.269 -0.27 . . . . 71.120000000000005 111.374 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -74.78 -19.8 18.05 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 120.602 0.868 . . . . 64.439999999999998 113.114 -155.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.4 11.2 ptpt 54.56 155.77 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.561 0 C-N-CA 128.166 2.587 . . . . 73.109999999999999 111.249 -158.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -59.49 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.424 -2.596 0 CA-C-O 126.043 2.435 . . . . 51.520000000000003 108.164 161.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.58 99.34 5.97 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 111.539 -2.573 . . . . 75.25 106.441 162.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.0 mt -123.75 138.94 51.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 127.9 2.48 . . . . 73.129999999999995 105.092 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -91.78 156.43 17.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.431 -1.259 . . . . 75.25 109.27 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 46.35 50.43 12.33 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 124.851 2.262 . . . . 74.239999999999995 109.329 -173.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -71.58 -6.77 43.3 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.297 2.239 . . . . 73.019999999999996 113.713 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -134.73 4.29 3.31 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 129.709 3.204 . . . . 74.25 111.378 -175.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.258 1.542 0 C-N-CA 125.571 1.548 . . . . 73.219999999999999 109.216 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 119.012 -0.518 . . . . 62.43 109.695 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.07 -22.82 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 129.644 3.178 . . . . 74.310000000000002 109.208 171.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 73.319999999999993 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.549999999999997 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.230000000000004 107.142 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.310000000000002 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.040000000000006 109.02 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 74.25 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.340000000000003 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.219999999999999 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.420000000000002 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 63.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.329999999999998 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.119999999999997 109.842 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.310000000000002 110.323 172.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 72.140000000000001 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.319999999999993 111.459 174.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 75.510000000000005 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.310000000000002 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 71.140000000000001 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 71.120000000000005 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.120000000000005 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 72.349999999999994 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.310000000000002 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.109999999999999 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.409999999999997 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.230000000000004 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.150000000000006 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 72.510000000000005 108.335 151.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.230000000000004 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 70.530000000000001 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 72.209999999999994 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 75.230000000000004 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.49 HD13 ' H ' ' A' ' 35' ' ' MET . 2.8 tm? -106.28 177.59 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.510000000000005 108.146 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.49 ' H ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -49.26 178.68 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.673 1.189 . . . . 55.32 113.804 169.405 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 77.18 -12.67 1.03 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 128.57 2.748 . . . . 73.540000000000006 112.467 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.68 -52.15 7.88 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-N 119.838 1.199 . . . . 73.319999999999993 111.851 -170.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 65.11 -48.26 0.35 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.357 2.263 . . . . 73.510000000000005 116.557 175.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.0 t -61.7 -59.2 5.53 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 120.964 1.711 . . . . 74.340000000000003 107.826 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.5 p -62.95 -22.05 66.51 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.746 0.647 . . . . 72.439999999999998 112.746 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.5 18.56 23.19 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 121.58 -0.7 . . . . 72.310000000000002 112.242 161.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -59.04 -162.76 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.979 2.112 . . . . 75.420000000000002 113.339 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.444 ' HB3' ' CB ' ' A' ' 35' ' ' MET . 0.0 OUTLIER 75.95 50.16 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 130.439 3.496 . . . . 72.329999999999998 116.548 -179.275 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -92.98 13.76 19.72 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.430000000000007 115.661 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.210000000000001 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 75.430000000000007 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.549999999999997 109.157 164.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.329999999999998 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 73.530000000000001 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 74.219999999999999 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.329999999999998 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.140000000000001 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 73.530000000000001 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 73.049999999999997 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.219999999999999 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.120000000000005 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 71.540000000000006 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 63.509999999999998 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.239999999999995 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 72.409999999999997 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.510000000000005 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.239999999999995 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 72.230000000000004 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.439999999999998 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 73.5 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.510000000000005 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.540000000000006 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 74.25 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 65.209999999999994 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 75.439999999999998 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.109999999999999 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 71.140000000000001 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.310000000000002 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.530000000000001 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.230000000000004 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.519999999999996 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.540000000000006 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 74.310000000000002 107.133 169.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 74.329999999999998 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.82 46.33 0.62 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 72.230000000000004 108.996 175.082 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.65 55.83 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.382 -0.372 . . . . 70.109999999999999 110.35 179.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.25 -14.97 20.45 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.636 1.558 . . . . 73.340000000000003 113.904 -168.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt 56.91 165.56 0.07 OUTLIER Pre-proline 0 C--O 1.236 0.357 0 C-N-CA 130.051 3.341 . . . . 72.420000000000002 113.313 -171.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.31 98.89 0.47 Allowed 'Trans proline' 0 N--CA 1.448 -1.199 0 N-CA-C 107.272 -1.857 . . . . 71.040000000000006 107.272 163.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -116.84 43.25 2.3 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.895 2.078 . . . . 73.430000000000007 107.926 -173.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -95.04 156.98 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 105.963 -1.866 . . . . 74.239999999999995 105.963 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -5.53 59.07 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.108 0.781 . . . . 73.030000000000001 113.108 171.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -141.24 105.13 4.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 128.109 2.564 . . . . 73.319999999999993 106.105 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -125.82 3.57 7.4 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.399 1.08 . . . . 71.219999999999999 110.496 -168.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -142.77 10.32 1.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.332 3.053 . . . . 74.140000000000001 110.485 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.249 1.049 0 C-N-CA 124.323 1.049 . . . . 62.43 108.194 167.442 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 CA--C 1.512 -0.486 0 N-CA-C 109.375 -0.602 . . . . 75.140000000000001 109.375 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 72.96 -1.46 3.03 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 130.953 3.701 . . . . 51.140000000000001 109.175 -178.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 61.229999999999997 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.439999999999998 108.554 -176.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.140000000000001 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.430000000000007 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 74.439999999999998 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.230000000000004 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.120000000000005 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.577 ' HB3' HE21 ' A' ' 73' ' ' GLN . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.140000000000001 111.723 163.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.310000000000002 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.329999999999998 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 71.040000000000006 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 74.030000000000001 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.310000000000002 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 62.229999999999997 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.239999999999995 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.450000000000003 108.631 176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 70.430000000000007 110.46 -174.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.329999999999998 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.430000000000007 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 72.319999999999993 110.339 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.319999999999993 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.140000000000001 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.476 ' CE1' HD22 ' A' ' 64' ' ' ASN . 76.7 m-70 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 75.010000000000005 112.325 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 54.539999999999999 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 75.430000000000007 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.310000000000002 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.310000000000002 111.472 -152.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 75.329999999999998 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.310000000000002 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.529 HD23 ' H ' ' A' ' 35' ' ' MET . 1.4 tm? -74.21 165.58 24.92 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 71.310000000000002 109.239 167.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.529 ' H ' HD23 ' A' ' 34' ' ' LEU . 50.9 mtp -58.58 13.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 129.884 3.274 . . . . 73.109999999999999 116.771 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 91.0 mtt-85 -138.44 118.83 13.74 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 120.368 -1.458 . . . . 74.140000000000001 107.386 173.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -177.11 118.56 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 C-N-CA 128.415 2.686 . . . . 72.120000000000005 107.633 159.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -22.56 66.5 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.936 1.244 . . . . 73.129999999999995 112.865 174.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -61.27 -32.4 72.23 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.57 1.148 . . . . 72.329999999999998 111.237 -169.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.1 t -130.65 -38.68 1.3 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.311 1.845 . . . . 75.140000000000001 109.139 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.98 21.59 55.07 Favored Glycine 0 C--N 1.341 0.835 0 O-C-N 121.408 -0.807 . . . . 75.340000000000003 112.223 -171.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -44.61 105.76 0.06 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 127.181 2.193 . . . . 75.219999999999999 107.642 167.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 58.0 p -177.23 156.57 1.25 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.922 2.489 . . . . 72.010000000000005 111.271 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 174.34 2.54 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 129.208 3.003 . . . . 75.209999999999994 114.385 169.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 72.329999999999998 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.009999999999998 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.009999999999998 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.409999999999997 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.329999999999998 105.288 162.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.319999999999993 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 74.209999999999994 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.420000000000002 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 64.439999999999998 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.120000000000005 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 75.230000000000004 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 72.219999999999999 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.544 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 75.349999999999994 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.109999999999999 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 71.049999999999997 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 72.219999999999999 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.109999999999999 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.230000000000004 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.340000000000003 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.476 HD22 ' CE1' ' A' ' 25' ' ' HIS . 62.7 m-80 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 75.150000000000006 111.768 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.439999999999998 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.209999999999994 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.450000000000003 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 75.340000000000003 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.329999999999998 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 75.319999999999993 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.349999999999994 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.230000000000004 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.577 HE21 ' HB3' ' A' ' 10' ' ' PRO . 2.2 pm0 -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.150000000000006 110.209 -177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.409999999999997 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.310000000000002 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 71.230000000000004 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 74.140000000000001 110.081 170.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.239999999999995 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.040000000000006 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.01 46.84 1.04 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 60.310000000000002 108.976 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -57.44 148.05 56.35 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 112.326 0.491 . . . . 64.030000000000001 112.326 -167.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -77.09 -23.11 10.77 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 N-CA-C 114.77 1.027 . . . . 63.210000000000001 114.77 -149.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.0 ptpt 54.24 165.51 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 128.911 2.884 . . . . 73.030000000000001 115.65 -177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -71.19 104.98 1.62 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 N-CA-C 107.772 -1.664 . . . . 71.140000000000001 107.772 157.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -109.39 26.52 10.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.945 1.298 . . . . 71.010000000000005 109.481 173.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 86' ' ' ILE . 1.1 mp -76.38 158.08 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 106.273 -1.751 . . . . 73.230000000000004 106.273 168.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -84.42 -3.32 58.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.699 0.629 . . . . 75.030000000000001 112.699 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -135.25 158.88 43.23 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 125.959 1.704 . . . . 61.439999999999998 108.0 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -133.88 11.18 3.97 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.398 1.079 . . . . 60.439999999999998 111.552 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -137.52 4.29 2.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.005 2.122 . . . . 74.200000000000003 111.441 -176.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.249 1.044 0 C-N-CA 125.735 1.614 . . . . 75.129999999999995 109.964 -179.175 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 118.367 -0.825 . . . . 73.32 112.381 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.51 108.068 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.51 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 55.01 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.15 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.611 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.31 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 33.43 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 63.11 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.24 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.23 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.23 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 53.11 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 73.23 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.35 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.34 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.32 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 73.11 110.122 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 60.34 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 71.12 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.864 HD13 ' HB2' ' A' ' 29' ' ' ALA . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 51.22 108.424 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.44 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 52.11 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 60.21 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 71.31 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 33.23 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.22 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.864 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.24 108.347 151.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 61.25 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 63.21 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.15 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' C ' HD13 ' A' ' 34' ' ' LEU . 3.4 tm? . . . . . 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.33 107.172 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 63.11 114.635 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.44 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.13 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.54 110.169 168.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.31 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.34 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.14 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 73.14 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.53 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.35 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.52 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 61.24 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 71.32 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 72.42 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.43 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 62.23 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 61.12 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 51.03 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 64.14 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 54.44 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.42 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 53.44 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 64.45 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.23 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 54.12 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.14 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 65.15 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 53.35 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.31 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.54 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 63.55 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.13 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.12 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.611 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.13 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.44 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.04 114.711 -175.99 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 114.686 1.365 . . . . 73.11 114.686 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 73.21 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.42 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.52 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.4 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.23 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 70.3 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.24 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.31 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.1 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.4 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.41 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 65.1 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.52 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.53 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.43 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.54 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 65.22 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.11 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 70.11 109.054 -177.394 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.4 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 71.42 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.34 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 54.24 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.512 HG11 ' CE2' ' A' ' 51' ' ' PHE . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.4 109.066 -171.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 72.41 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 44.0 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 62.3 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.42 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.33 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 70.04 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tm? . . . . . 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 70.5 110.258 178.809 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.11 114.876 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.34 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.1 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.12 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.21 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 43.01 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.32 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.512 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 72.3 109.59 -178.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.23 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 72.43 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.43 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.419 HE22 ' HD3' ' A' ' 59' ' ' ARG . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.32 112.286 -176.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 70.3 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 62.11 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 63.51 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HE22 ' A' ' 55' ' ' GLN . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 71.12 112.885 -176.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.2 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.2 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.44 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.2 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 63.11 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.14 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.4 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.53 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 53.44 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.52 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.42 106.774 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 71.12 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.44 112.131 -174.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.24 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 52.11 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 64.12 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.33 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.51 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.42 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.31 111.85 175.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.12 109.547 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.063 -0.97 . . . . 61.15 111.332 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.42 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' ' 77' ' ' MET . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 63.45 105.923 161.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 73.34 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.41 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.54 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 61.41 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 64.51 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.01 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.04 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 64.4 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.32 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.42 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.14 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.2 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.444 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 73.13 110.779 -172.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.4 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.23 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 29' ' ' ALA . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.21 108.823 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.34 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.43 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.01 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.3 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.33 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 63.32 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.767 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.42 114.06 -174.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 53.45 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.35 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.22 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.32 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.21 106.736 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.377 0.51 . . . . 55.41 112.377 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 54.04 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.23 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.34 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 62.14 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.52 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 72.51 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.24 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 73.51 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 71.25 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.55 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.13 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.12 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 74.44 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.21 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.415 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.22 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.23 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 34.15 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 62.0 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 74.0 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 73.43 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.32 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.22 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 64.3 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 64.2 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.2 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.02 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.44 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 71.2 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.11 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.22 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.413 ' HB2' HG13 ' A' ' 4' ' ' VAL . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 64.41 109.961 171.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.2 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.22 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 112.568 0.581 . . . . 70.53 112.568 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.22 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.3 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.3 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.23 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.22 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.23 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 18' ' ' ILE . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 73.33 109.308 163.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.21 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.41 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.34 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.4 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.13 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.44 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.32 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.13 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.418 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.22 109.266 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.32 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.33 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.13 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 29' ' ' ALA . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 72.34 108.332 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.44 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.44 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.24 112.547 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 63.11 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 64.12 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.11 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.463 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 52.32 108.672 157.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.54 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 63.34 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 62.12 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.53 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.2 108.608 165.22 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 118.393 -0.813 . . . . 74.43 112.947 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.02 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.52 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.42 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.21 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 54.33 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.54 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 64.53 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 23.44 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.54 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 73.4 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.52 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.52 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 52.4 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 64.54 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 65.52 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.21 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 70.14 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 41.22 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 71.22 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.31 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.3 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.14 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 71.22 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.32 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.12 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 61.33 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.42 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HE3' ' C ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.32 106.599 170.695 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.407 ' N ' ' HE3' ' A' ' 74' ' ' LYS . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.33 108.244 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.52 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.22 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.24 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.53 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.42 108.814 160.659 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.223 -0.314 0 CA-C-O 122.578 1.18 . . . . 73.33 109.912 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.31 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.21 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.34 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.34 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.14 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.02 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 63.32 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.15 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.23 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.43 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 64.24 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.01 111.845 -176.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.35 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 65.54 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.01 109.286 172.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.426 HD11 HD23 ' A' ' 34' ' ' LEU . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.45 109.191 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.35 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.44 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.35 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.801 HD13 ' HB2' ' A' ' 29' ' ' ALA . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.42 110.923 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.11 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.33 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.23 111.687 163.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.01 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.41 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.44 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.801 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.23 114.317 -170.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.14 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.44 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' HB1' ' A' ' 29' ' ' ALA . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 72.15 111.674 -167.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 72.23 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.426 HD23 HD11 ' A' ' 18' ' ' ILE . 1.7 tm? . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.22 109.986 172.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 70.15 114.928 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.42 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.43 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 50.44 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 70.31 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.44 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.2 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.1 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.54 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.33 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 64.32 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 64.3 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.11 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 52.44 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.21 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.14 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.13 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.44 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 64.23 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.41 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 71.03 113.073 168.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 51.3 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.4 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 51.45 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 70.33 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 65.44 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 65.25 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.43 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 51.33 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.32 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.14 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 65.32 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.05 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.13 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.02 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.2 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.2 107.064 173.198 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 120.48 0.181 . . . . 73.34 110.624 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 64.55 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.45 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 64.43 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.31 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.451 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.42 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.15 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.14 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.12 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 51.43 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.12 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 73.35 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.51 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' HD22 ' A' ' 34' ' ' LEU . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 64.43 109.719 172.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.44 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.34 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 65.14 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 64.42 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 61.23 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 72.31 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 62.42 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 53.41 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.24 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.55 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.02 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.52 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.403 ' NE2' ' H ' ' A' ' 28' ' ' GLN . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 72.34 107.224 167.013 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 65.31 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 74.25 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.42 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 71.45 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.03 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.424 HD22 ' N ' ' A' ' 15' ' ' GLU . 4.7 tt . . . . . 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 63.55 108.766 164.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 72.51 110.958 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.33 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 52.12 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 72.41 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.43 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.42 105.693 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.24 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.41 111.813 -164.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.14 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.05 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 63.11 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.31 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.21 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.52 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 63.12 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.54 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 72.43 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.415 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 53.34 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.15 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.04 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.35 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 65.52 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.41 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 72.12 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 70.23 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.42 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 70.45 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.23 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.21 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.11 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 54.21 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 64.22 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.41 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.451 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 62.24 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 73.41 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 62.52 108.767 171.54 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 118.218 -0.896 . . . . 71.12 113.275 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 70.1 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 73.21 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.31 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.34 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 71.33 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.43 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.32 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.34 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.13 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 51.43 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 71.32 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.11 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 63.54 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.23 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.31 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 72.22 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.52 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 64.31 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.4 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 71.31 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.4 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.51 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HG22 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 51.34 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.34 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.32 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.21 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.2 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.15 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.32 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.41 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 73.3 107.986 173.642 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.34 115.296 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 43.33 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.23 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.42 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 65.33 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.43 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.43 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 72.4 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.3 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 73.13 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.41 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 72.52 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.33 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.2 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.32 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 74.54 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.22 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 62.22 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.3 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.02 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.1 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.04 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.34 114.908 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 62.22 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 71.34 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.21 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 63.12 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 53.43 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 25.5 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.43 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.04 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.2 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.42 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 52.52 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.2 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.33 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.22 108.148 173.662 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 119.422 -0.323 . . . . 70.32 111.271 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 63.12 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 62.02 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.54 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 61.44 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 63.54 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 61.34 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 35.34 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.51 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.21 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.41 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 50.22 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.583 ' N ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.45 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.32 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.04 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 64.41 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HA ' HD21 ' A' ' 22' ' ' LEU . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.12 113.122 -169.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 41.25 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.24 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.634 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.21 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 64.44 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.02 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.51 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 62.42 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.754 HG11 ' CE2' ' A' ' 51' ' ' PHE . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.01 109.439 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.04 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.626 ' H ' HG12 ' A' ' 27' ' ' VAL . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 43.41 112.137 -146.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.24 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.01 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 70.01 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.21 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.12 111.624 173.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.426 1.269 . . . . 51.33 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.22 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.22 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 61.22 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 74.14 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.452 HG11 ' CZ3' ' A' ' 60' ' ' TRP . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.34 107.464 174.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.41 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.754 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 71.41 109.604 -178.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.24 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.44 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.11 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.34 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 24.02 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.42 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.34 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TRP . . . . . 0.634 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 61.15 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.35 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.21 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 71.32 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.45 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.11 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 54.23 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 34.52 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 34.33 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.35 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 52.04 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 35.11 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.54 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 74.15 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 72.44 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.33 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 63.55 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.24 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.42 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.14 112.752 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 118.515 -0.755 . . . . 74.13 112.51 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.409 HG12 ' CB ' ' A' ' 50' ' ' GLU . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.32 105.884 -176.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 72.02 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.34 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.41 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.12 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.3 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.541 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.01 111.236 -175.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 12' ' ' ALA . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.43 112.406 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 74.21 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 10' ' ' PRO . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.52 114.188 -170.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 72.51 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 55.42 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.2 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 63.1 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.54 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.494 ' CD1' HD23 ' A' ' 34' ' ' LEU . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 72.13 109.416 172.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 71.53 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.13 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.52 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.11 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.32 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.22 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.34 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 54.41 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 73.1 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.53 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.1 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.3 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.44 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 63.43 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.05 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.494 HD23 ' CD1' ' A' ' 18' ' ' ILE . 1.3 tm? . . . . . 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.3 109.638 174.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 115.026 1.491 . . . . 71.12 115.026 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.12 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.42 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.541 ' HB2' ' CD2' ' A' ' 9' ' ' LEU . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.41 109.247 -176.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 72.03 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 52.53 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CB ' HG12 ' A' ' 3' ' ' ILE 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 71.13 113.14 164.45 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.23 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.34 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.21 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 65.23 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 62.22 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.34 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.2 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.31 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.32 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.11 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.23 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.22 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.1 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 52.44 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.34 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 70.01 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.54 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.44 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.3 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.3 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.3 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 53.44 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.42 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.1 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 63.4 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.41 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.44 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.42 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.34 108.469 158.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 119.214 -0.422 . . . . 71.54 112.001 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.41 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 72.43 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.45 ' C ' HD22 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.4 109.861 166.252 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.461 HD21 ' CZ3' ' A' ' 60' ' ' TRP . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.12 108.548 -168.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 60.54 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.24 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.41 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.32 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 72.11 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 71.53 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.21 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.14 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.21 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 55.24 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.524 ' HA ' HD12 ' A' ' 22' ' ' LEU . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.42 110.126 173.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.41 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 63.41 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' ' 29' ' ' ALA . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.53 108.26 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 55.24 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 64.32 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.52 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.24 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.506 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 72.31 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.689 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.32 115.227 -165.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.41 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.4 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.11 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.21 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.42 113.333 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 108.242 -1.022 . . . . 71.12 108.242 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.32 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 54.44 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.42 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.12 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.54 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.32 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.43 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 41.23 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.5 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 52.12 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 73.14 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 64.21 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 73.33 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 61.24 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 55.23 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.15 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.31 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.13 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.21 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.32 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 71.31 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 61.42 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.32 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 72.54 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.44 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.13 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.32 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.55 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.55 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.41 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.15 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.23 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.54 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 72.13 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 71.13 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.22 106.984 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 108.636 -0.875 . . . . 73.44 108.636 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 63.14 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 60.15 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.42 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 71.41 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 73.41 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.35 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 51.04 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.51 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.11 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.22 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.12 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.43 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.55 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 71.55 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 73.33 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 22' ' ' LEU . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.04 107.017 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.33 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.11 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 63.54 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.843 HD13 ' HB2' ' A' ' 29' ' ' ALA . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 71.32 109.068 -177.183 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 61.55 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 63.45 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.13 112.971 174.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 54.23 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 71.52 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.554 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.54 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.843 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.31 109.937 -157.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.41 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 73.23 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 61.32 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.14 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 47' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 54.05 108.261 175.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 64.15 114.351 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.15 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 72.45 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.485 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.13 110.517 -177.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 74.13 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 44.23 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.35 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.614 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.23 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.41 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 62.13 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.33 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.41 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.34 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.43 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 61.54 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.23 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.54 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.23 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 64.33 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 35.4 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.33 111.355 -176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 72.12 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 73.11 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.53 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.22 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.45 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.432 HD12 HG21 ' A' ' 75' ' ' VAL . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 74.22 106.392 -166.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 73.34 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.22 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.21 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.432 HG21 HD12 ' A' ' 70' ' ' ILE . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 62.21 106.688 168.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.55 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 73.43 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.44 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.53 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 72.15 106.127 163.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.446 -0.625 0 N-CA-C 108.135 -1.061 . . . . 74.33 108.135 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 53.34 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 61.45 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 63.23 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 61.14 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.42 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.42 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.03 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 55.44 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 41.31 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.31 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.11 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.41 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.14 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 62.31 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.22 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 64.15 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 72.15 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 62.15 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.565 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 64.02 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.15 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 72.02 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 55.51 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.03 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.02 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.04 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.42 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 62.35 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.13 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.12 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.35 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.12 106.352 166.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 . . . . . 0 CA--C 1.532 0.264 0 N-CA-C 112.118 0.414 . . . . 74.21 112.118 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.21 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.15 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.24 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.21 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 61.12 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.32 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.21 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.24 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 54.51 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 60.11 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.43 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.45 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 53.35 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.05 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.42 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TRP . . . . . 0.565 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.33 111.454 176.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.43 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.25 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 60.25 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.45 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 62.44 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.43 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 63.03 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 72.33 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.05 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 71.45 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 73.03 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 71.42 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 62.32 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 63.41 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 72.12 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 53.55 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.41 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 53.41 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.15 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 54.45 108.024 172.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 111.461 0.171 . . . . 73.32 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 73.21 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 52.34 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.44 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 61.3 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.41 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.23 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.42 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.14 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.24 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.03 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.35 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.01 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.44 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.42 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 22' ' ' LEU . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.32 110.744 176.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 73.21 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.3 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 29' ' ' ALA . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 64.1 109.813 172.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 63.43 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.52 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.14 111.423 176.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.13 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.03 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.23 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.508 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.42 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.35 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 60.41 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 72.45 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 63.34 109.341 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 119.218 -0.42 . . . . 75.21 111.988 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.11 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.15 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 53.41 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.11 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 51.12 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.35 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 61.31 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 63.35 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.33 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.41 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.45 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.23 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.13 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.24 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.24 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.01 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.23 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.01 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.44 110.778 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.24 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 63.3 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.1 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 63.13 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 61.4 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.2 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 60.2 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.3 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.12 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 64.41 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 53.21 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.34 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 71.01 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 64.8 m80 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 71.25 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.23 106.521 162.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.41 107.689 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 62.24 111.412 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 64.41 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 ' HB ' ' A' ' 49' ' ' VAL 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.1 115.764 172.695 . . . . . . . . 5 4 . 1 . 014 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 50.14 108.58 167.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.615 HD11 ' HH2' ' A' ' 60' ' ' TRP . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 71.34 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.21 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 62.12 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.35 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.44 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 70.15 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.5 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 45.55 112.57 -170.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 71.13 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.43 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.02 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 45.55 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 64.24 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HA ' HD12 ' A' ' 22' ' ' LEU . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 50.33 111.055 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.43 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.13 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.746 HD13 ' CB ' ' A' ' 29' ' ' ALA . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 71.23 109.809 -178.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 62.45 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.22 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 54.51 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.14 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 44.44 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.23 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.746 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 50.41 112.892 -164.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 73.3 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 70.33 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.41 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.03 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 72.22 110.813 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 119.391 -0.338 . . . . 71.34 111.622 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 62.45 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 52.32 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 54.4 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.43 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.682 ' HB ' HG13 ' A' ' 4' ' ' VAL . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 54.11 106.981 168.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.23 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 61.2 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 62.13 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.43 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.22 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.03 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.1 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 63.32 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.1 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TRP . . . . . 0.615 ' HH2' HD11 ' A' ' 6' ' ' LEU . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 70.41 113.543 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.1 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.43 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.02 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 52.14 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 65.44 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.4 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 63.24 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.05 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.03 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.488 HG22 ' HG ' ' A' ' 71' ' ' LEU . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 63.34 108.541 -177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.488 ' HG ' HG22 ' A' ' 70' ' ' ILE . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 71.24 111.689 -175.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.31 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.15 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 72.01 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 54.12 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.24 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.467 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 54.4 110.078 165.681 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 60.3 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 73.42 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 1.9 t . . . . . 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.43 108.125 178.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 118.979 -0.534 . . . . 73.42 111.649 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.34 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.32 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.44 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 65.44 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.12 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.24 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.43 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.4 108.453 167.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.22 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 44.31 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 62.11 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 43.43 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 73.34 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.41 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.12 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 22' ' ' LEU . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 61.53 107.56 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 61.3 110.313 -174.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 74.34 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 71.3 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.836 HD13 ' CB ' ' A' ' 29' ' ' ALA . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 71.32 108.108 172.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.33 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.21 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 54.3 107.361 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.23 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.452 ' CG1' ' CE2' ' A' ' 51' ' ' PHE . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 54.21 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.836 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.12 113.776 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 74.4 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.13 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.412 HG11 HD12 ' A' ' 18' ' ' ILE . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.43 108.25 173.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.13 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.12 110.408 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 118.645 -0.693 . . . . 74.2 111.481 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.34 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 70.53 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 44.24 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.21 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 45.5 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 72.25 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 70.12 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.55 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.02 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.406 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.35 113.542 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.34 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.12 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.13 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 65.23 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 73.41 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.21 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.22 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.54 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 51.44 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.24 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.3 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 72.1 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.14 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 62.24 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 64.21 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 71.54 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 60.12 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.44 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.13 108.253 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 72.43 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.4 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 70.53 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 64.24 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.13 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 70.54 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.14 105.516 153.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 110.003 -0.369 . . . . 62.01 110.003 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.33 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.12 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 72.21 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 72.13 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.24 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.12 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 60.24 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.14 110.749 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.12 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 51.31 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.426 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.31 111.669 -167.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.43 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.42 110.348 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 43.54 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.22 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.11 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.12 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 14.2 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 73.12 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.541 ' CD1' ' HB2' ' A' ' 29' ' ' ALA . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 65.41 109.365 168.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.33 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.11 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.22 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 53.34 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 61.15 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.15 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.541 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 64.11 109.168 152.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.42 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.3 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 51.54 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.14 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.404 ' HG ' ' HB2' ' A' ' 47' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.03 106.983 169.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 112.082 0.401 . . . . 74.53 112.082 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.43 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.404 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 52.53 110.254 -163.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.04 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 52.51 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 70.12 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.14 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.05 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.21 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.05 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.12 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.11 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.32 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 62.34 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.45 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.44 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.34 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.31 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.15 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 71.42 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 72.14 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.12 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.12 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.12 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 55.34 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.438 HD12 HG21 ' A' ' 75' ' ' VAL . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.14 106.618 -177.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.43 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 54.25 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 72.35 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.438 HG21 HD12 ' A' ' 70' ' ' ILE . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 74.24 106.327 -177.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 64.53 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.42 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.54 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 73.54 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.44 110.298 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 N--CA 1.466 0.367 0 CA-C-O 118.925 -0.559 . . . . 70.11 111.928 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.25 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.24 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.23 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 75' ' ' VAL . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.24 110.569 -177.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 54.31 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.22 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.51 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.45 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.13 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.41 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 63.23 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.51 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 72.51 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.21 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 71.13 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 74.33 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 33.13 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.14 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.4 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 62.33 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.42 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.53 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 54.21 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.53 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.52 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.43 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 64.15 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 61.53 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 72.43 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' A' ' 47' ' ' ALA . 1.6 tm? . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 118.261 -0.876 . . . . 71.42 111.732 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.22 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 64.54 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.554 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 31.13 110.565 165.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.12 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 61.21 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.51 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 62.11 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.34 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 70.54 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 71.4 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.12 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.22 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.22 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.12 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.22 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.11 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 64.12 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 71.13 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 70.43 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.44 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 70.34 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 63.15 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 35.23 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.41 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.32 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 73.21 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.23 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.01 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.03 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.54 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 7' ' ' ARG . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.53 105.978 -178.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.03 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.12 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.24 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.01 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.34 109.469 176.275 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.913 -1.041 . . . . 64.23 109.208 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 70.05 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.55 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.482 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.23 107.142 -177.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.31 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.403 HH21 ' CE1' ' A' ' 78' ' ' HIS . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.04 109.02 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 71.23 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.34 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.22 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.42 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 51.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.33 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.546 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.12 109.842 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 34' ' ' LEU . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.31 110.323 172.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 62.54 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.546 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.32 111.459 174.745 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 61.53 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.31 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 53.13 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 65.15 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.12 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 71.55 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.31 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.11 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.41 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.23 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.15 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 43.32 108.335 151.359 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.23 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 63.45 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 63.45 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 72.03 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.66 HD23 ' HB2' ' A' ' 47' ' ' ALA . 2.8 tm? . . . . . 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.51 108.146 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.43 115.661 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.21 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 61.51 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.55 109.157 164.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.33 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 63.21 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 71.04 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.33 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.14 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 70.25 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 54.12 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.22 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.12 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 65.44 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 62.34 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.24 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 63.22 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.51 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.24 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 61.31 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.44 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 54.42 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.51 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.54 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 72.53 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 63.33 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 41.34 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.11 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 62.55 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.31 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.53 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.23 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.52 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.54 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 7' ' ' ARG . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 70.11 107.133 169.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 62.31 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 61.14 108.996 175.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.191 0 N-CA-C 109.175 -0.676 . . . . 41.14 109.175 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 54.4 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 49' ' ' VAL . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.44 108.554 -176.506 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.14 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.43 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 73.2 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.23 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.12 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.14 111.723 163.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.31 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.33 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 44.34 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 73.22 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.31 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 61.11 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.24 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 34' ' ' LEU . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.45 108.631 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.586 ' HA ' HD12 ' A' ' 22' ' ' LEU . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 53.34 110.46 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.02 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.43 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 29' ' ' ALA . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 71.14 110.339 -172.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.32 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.14 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 74.22 112.325 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 53.24 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 74.12 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.31 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.784 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.31 111.472 -152.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 52.21 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.11 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.31 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 18' ' ' ILE . 1.4 tm? . . . . . 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 55.11 109.239 167.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 114.385 1.254 . . . . 75.21 114.385 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 60.44 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.01 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.01 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.41 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.492 ' HB ' HG13 ' A' ' 4' ' ' VAL . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.33 105.288 162.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.32 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 54.55 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.42 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 44.31 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.12 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 53.22 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 63.04 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 61.44 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.11 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 64.13 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 71.24 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.11 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.23 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.34 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 62.01 111.768 172.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.44 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.21 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.14 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 71.13 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.33 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 74.02 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.35 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.23 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.608 HE21 ' N ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.15 110.209 -177.779 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.41 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.31 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 53.24 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.412 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 55.54 110.081 170.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.24 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.04 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 40.5 108.976 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.018 -0.992 . . . . 73.32 110.543 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -116.13 -3.75 12.02 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.277 1.399 . . . . 73.32 112.381 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.5 HD11 ' HA ' ' A' ' 83' ' ' LYS . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.51 108.068 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.51 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 55.01 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.15 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.611 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.31 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 33.43 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 63.11 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.24 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.23 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.23 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 53.11 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 73.23 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.35 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.34 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.32 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 73.11 110.122 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 60.34 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 71.12 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.864 HD13 ' HB2' ' A' ' 29' ' ' ALA . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 51.22 108.424 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.44 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 52.11 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 60.21 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 71.31 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 33.23 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.22 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.864 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.24 108.347 151.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 61.25 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 63.21 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.15 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.414 ' C ' HD13 ' A' ' 34' ' ' LEU . 3.4 tm? -145.32 115.3 7.4 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.33 107.172 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.35 1.1 ptp 43.87 -154.51 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.057 1.743 . . . . 54.23 112.738 -171.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 75.71 -48.44 0.6 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.161 2.984 . . . . 73.13 113.841 165.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -50.71 -39.06 50.58 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.368 1.867 . . . . 74.54 111.958 -175.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 47.05 -66.5 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.753 2.421 . . . . 73.33 114.106 -144.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.0 t -49.04 -66.65 0.36 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.412 1.885 . . . . 34.43 111.72 -161.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 t -66.51 -33.55 75.93 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.268 0.355 . . . . 71.21 110.753 -170.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.83 21.41 2.64 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-O 117.811 -1.55 . . . . 73.24 113.719 161.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.47 4.0 0.61 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.49 1.663 . . . . 75.11 115.49 -165.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.21 72.13 0.78 Allowed 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 126.617 1.967 . . . . 41.45 108.431 -168.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -133.4 -6.16 2.95 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 63.11 114.635 -173.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.44 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.13 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.54 110.169 168.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.31 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.34 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.14 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 73.14 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.53 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.35 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.52 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 61.24 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 71.32 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 72.42 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.43 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 62.23 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 61.12 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 51.03 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 64.14 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 54.44 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.42 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 53.44 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 64.45 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.23 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 54.12 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.14 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 65.15 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 53.35 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.31 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.54 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 63.55 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.13 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.12 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.611 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.13 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.44 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t -75.73 -6.68 51.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.04 114.711 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -171.51 166.38 4.14 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 124.98 1.312 . . . . 55.33 108.804 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -68.9 -56.15 0.18 Allowed 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 121.245 1.297 . . . . 51.43 111.615 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HA ' HD11 ' A' ' 3' ' ' ILE . 16.1 ptmt -160.1 158.11 25.9 Favored Pre-proline 0 C--O 1.238 0.454 0 C-N-CA 127.234 2.214 . . . . 54.44 109.258 174.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.14 106.41 1.54 Allowed 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 124.516 3.478 . . . . 75.13 108.905 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -109.19 19.46 19.43 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.5 1.12 . . . . 74.24 112.435 -175.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.537 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.8 mp -62.01 153.53 5.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 107.067 -1.457 . . . . 73.42 107.067 169.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -5.32 57.93 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 64.31 112.329 176.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -120.99 159.57 25.33 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 129.13 2.972 . . . . 73.24 108.726 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -144.56 11.61 1.47 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.38 1.472 . . . . 74.21 111.129 -175.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -135.37 8.25 3.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.807 2.443 . . . . 72.11 111.827 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 C--O 1.248 0.976 0 CA-C-O 116.465 -1.731 . . . . 64.22 107.103 174.417 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.404 ' HB2' ' CD1' ' A' ' 79' ' ' TYR . 4.2 m . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 117.79 -1.1 . . . . 72.22 110.19 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -143.0 13.36 1.86 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.775 1.625 . . . . 73.11 114.686 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 73.21 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.42 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.52 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.4 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.23 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 70.3 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.24 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.31 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.1 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.4 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.41 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 65.1 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.52 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.53 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.43 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.54 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 65.22 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.11 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 70.11 109.054 -177.394 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.4 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 71.42 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.34 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 54.24 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.512 HG11 ' CE2' ' A' ' 51' ' ' PHE . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.4 109.066 -171.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 72.41 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 44.0 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 62.3 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.42 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.33 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 70.04 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD22 ' H ' ' A' ' 35' ' ' MET . 1.8 tm? -87.71 164.0 16.23 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 70.5 110.258 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 43' ' ' SER . 45.0 mtp -54.32 87.54 0.0 OUTLIER 'General case' 0 C--O 1.236 0.374 0 C-N-CA 127.816 2.446 . . . . 64.41 111.966 168.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.53 -74.28 0.34 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.256 2.223 . . . . 71.33 108.081 169.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' ND2' ' HB2' ' A' ' 40' ' ' SER . 63.3 t-20 -64.24 94.37 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.7 1.6 . . . . 73.1 113.01 -169.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -33.54 76.09 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 118.335 -0.841 . . . . 63.11 112.943 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -43.67 71.3 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.491 0.587 . . . . 62.11 110.79 -173.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.441 ' HB2' ' ND2' ' A' ' 37' ' ' ASN . 5.4 t -63.1 -58.73 6.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.062 -1.088 . . . . 64.03 108.062 168.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.44 38.55 1.92 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.939 -1.264 . . . . 73.42 109.939 -169.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.73 5.03 3.42 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.813 0.806 . . . . 72.34 111.503 169.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.487 ' HA ' ' HG2' ' A' ' 35' ' ' MET . 11.3 p -131.01 102.78 6.18 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.348 1.459 . . . . 72.22 109.701 -158.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -153.53 0.21 0.24 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.11 114.876 -172.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.34 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.1 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.12 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.21 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 43.01 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.32 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.512 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 72.3 109.59 -178.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.23 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 72.43 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.43 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.419 HE22 ' HD3' ' A' ' 59' ' ' ARG . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.32 112.286 -176.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 70.3 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 62.11 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 63.51 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HE22 ' A' ' 55' ' ' GLN . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 71.12 112.885 -176.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.2 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.2 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.44 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.2 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 63.11 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.14 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.4 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.53 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 53.44 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.52 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.42 106.774 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 71.12 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.44 112.131 -174.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.24 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 52.11 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 64.12 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.33 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.51 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.42 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' A' ' 1' ' ' SER . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.31 111.85 175.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.03 61.56 2.97 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.12 109.547 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -51.48 155.38 2.64 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 125.768 1.627 . . . . 73.1 113.899 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.02 -45.56 7.69 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 121.868 1.712 . . . . 73.41 111.578 -174.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 84' ' ' PRO . 8.3 ptmt 58.1 164.95 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 131.312 3.845 . . . . 71.04 113.397 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 56.7 Cg_endo -66.99 106.21 1.11 Allowed 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.237 1.958 . . . . 43.33 109.153 165.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -117.49 26.35 9.79 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.28 1.432 . . . . 32.02 111.863 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.627 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.6 mp -67.18 158.84 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 O-C-N 120.244 -1.535 . . . . 74.2 107.843 -177.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.21 137.04 35.89 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.606 -1.257 . . . . 72.01 107.606 169.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.8 71.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 123.851 1.786 . . . . 74.04 110.167 -168.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -74.48 -15.08 60.9 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 113.39 -1.732 . . . . 72.24 112.742 -167.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -130.16 4.28 4.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.827 1.651 . . . . 71.12 113.031 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 91' ' ' LEU . 3.2 mm? . . . . . 0 C--O 1.244 0.804 0 N-CA-C 103.877 -2.638 . . . . 70.21 103.877 168.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.251 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 116.994 -1.479 . . . . 64.33 114.772 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 76.34 -2.51 2.71 Favored 'General case' 0 C--N 1.349 0.565 0 C-N-CA 127.74 2.416 . . . . 61.15 111.332 -166.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.42 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' ' 77' ' ' MET . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 63.45 105.923 161.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 73.34 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.41 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.54 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 61.41 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 64.51 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.01 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.04 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 64.4 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.32 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.42 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.14 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.2 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.444 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 73.13 110.779 -172.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.4 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.23 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 29' ' ' ALA . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.21 108.823 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.34 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.43 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.01 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.3 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.33 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 63.32 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.767 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.42 114.06 -174.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 53.45 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.35 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.22 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.32 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -140.53 -152.82 0.43 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.21 106.736 176.653 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.43 ' H ' HD13 ' A' ' 34' ' ' LEU . 5.8 ttp 69.49 -153.39 0.14 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.85 1.66 . . . . 53.4 109.347 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.6 149.92 42.96 Favored 'General case' 0 CA--C 1.497 -1.087 0 C-N-CA 125.726 1.61 . . . . 71.11 107.997 -177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -153.24 -50.68 0.1 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.925 0.869 . . . . 74.44 112.48 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.08 -24.16 0.07 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 116.899 2.185 . . . . 41.12 116.899 -174.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.2 m -76.53 -74.96 0.21 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.203 1.365 . . . . 52.31 108.021 162.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -70.79 -26.45 63.33 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.289 0.949 . . . . 73.12 113.519 -169.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.34 16.29 27.71 Favored Glycine 0 C--N 1.339 0.748 0 O-C-N 120.888 -1.133 . . . . 71.54 113.095 161.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -62.98 4.33 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.386 2.675 . . . . 73.22 115.991 -173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 99.7 p -141.47 106.08 4.88 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.463 -1.31 . . . . 75.54 107.463 -156.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -142.72 14.98 1.95 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.71 0.804 . . . . 55.41 112.377 -172.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 54.04 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.23 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.34 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 62.14 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.52 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 72.51 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.24 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 73.51 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 71.25 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.55 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.13 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.12 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 74.44 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.21 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.415 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.22 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.23 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 34.15 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 62.0 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 74.0 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 73.43 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.32 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.22 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 64.3 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 64.2 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.2 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.02 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.44 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 71.2 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.11 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.22 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.413 ' HB2' HG13 ' A' ' 4' ' ' VAL . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 64.41 109.961 171.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.2 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.22 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t -144.18 53.34 1.28 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -45.01 144.62 1.91 Allowed Pre-proline 0 N--CA 1.464 0.236 0 C-N-CA 125.204 1.402 . . . . 75.12 114.02 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -67.89 -35.57 20.57 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.877 1.718 . . . . 74.14 110.247 -173.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -140.04 158.24 67.58 Favored Pre-proline 0 N--CA 1.451 -0.404 0 C-N-CA 124.523 1.129 . . . . 74.11 110.297 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.06 99.86 1.04 Allowed 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.115 2.543 . . . . 72.45 109.773 173.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -102.94 31.44 4.2 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.255 1.022 . . . . 72.21 110.915 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.563 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.1 mp -69.91 167.42 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.414 1.485 . . . . 72.41 108.631 172.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -101.71 153.16 20.04 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.304 -1.497 . . . . 71.23 108.143 165.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 44.22 65.66 1.0 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 128.735 2.814 . . . . 72.53 112.712 174.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.75 -40.51 63.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.325 0.65 . . . . 74.52 111.216 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 50.9 p-90 -89.34 1.71 55.39 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.374 1.469 . . . . 72.52 112.482 -171.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.25 1.086 0 N-CA-C 105.546 -2.02 . . . . 75.11 105.546 171.911 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.291 4.0 m . . . . . 0 N--CA 1.473 0.72 0 CA-C-O 115.912 -1.994 . . . . 64.24 112.703 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER 54.13 20.71 2.65 Favored 'General case' 0 C--N 1.349 0.584 0 C-N-CA 127.528 2.331 . . . . 70.53 112.568 -170.136 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.22 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.3 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.3 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.23 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.22 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.23 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 18' ' ' ILE . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 73.33 109.308 163.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.21 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.41 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.34 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.4 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.13 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.44 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.32 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.13 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.418 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.22 109.266 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.32 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.33 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.13 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 29' ' ' ALA . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 72.34 108.332 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.44 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.44 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.24 112.547 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 63.11 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 64.12 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.11 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.463 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 52.32 108.672 157.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.54 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 63.34 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 62.12 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.53 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.78 88.33 2.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.2 108.608 165.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.5 ptm -168.65 142.33 3.07 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.354 0.979 . . . . 74.2 110.92 154.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -48.76 112.19 0.57 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 125.183 1.393 . . . . 74.1 110.748 -175.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -160.45 106.02 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.104 0.962 . . . . 71.23 112.088 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 1.6 2.14 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 115.686 1.735 . . . . 71.35 115.686 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.79 -2.1 18.78 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.917 1.687 . . . . 52.23 112.162 -177.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.3 m -131.13 -40.36 1.15 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.757 1.223 . . . . 53.12 109.416 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.71 54.34 2.96 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 107.744 -2.142 . . . . 52.04 107.744 -172.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -91.2 -177.14 4.8 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 124.376 0.692 . . . . 72.5 110.138 168.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.05 -152.81 0.21 Allowed 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.715 -0.616 . . . . 73.44 110.961 164.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.37 -3.14 2.66 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 127.559 2.344 . . . . 74.43 112.947 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.02 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.52 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.42 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.21 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 54.33 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.54 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 64.53 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 23.44 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.54 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 73.4 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.52 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.52 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 52.4 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 64.54 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 65.52 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.21 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 70.14 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 41.22 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 71.22 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.31 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.3 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.14 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 71.22 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.32 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.12 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 61.33 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.42 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HE3' ' C ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.32 106.599 170.695 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.407 ' N ' ' HE3' ' A' ' 74' ' ' LYS . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.33 108.244 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.52 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.22 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.24 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.53 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t -146.9 -159.19 0.99 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.42 108.814 160.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.05 165.03 38.91 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 128.673 2.789 . . . . 72.5 109.687 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.04 -28.73 10.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 121.606 1.537 . . . . 54.23 114.006 -168.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt 54.32 155.15 0.05 OUTLIER Pre-proline 0 C--O 1.239 0.501 0 C-N-CA 129.788 3.235 . . . . 74.54 114.569 -164.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.4 101.99 0.92 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 N-CA-C 107.701 -1.692 . . . . 65.55 107.701 162.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -118.77 15.6 13.52 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 127.066 2.146 . . . . 64.11 112.137 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.698 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.5 mp -67.17 137.16 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 N-CA-C 105.694 -1.965 . . . . 71.15 105.694 164.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -68.01 -5.78 19.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.302 1.223 . . . . 70.41 114.302 175.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -143.36 122.36 12.81 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 126.913 2.085 . . . . 72.44 106.975 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.71 5.61 47.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.818 1.247 . . . . 74.51 111.705 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 46.7 p-90 -135.84 6.97 3.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 125.461 1.504 . . . . 74.34 112.762 -173.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--O 1.248 1.018 0 CA-C-O 115.393 -2.241 . . . . 71.23 108.521 -179.986 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.275 19.5 m . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 116.34 -1.79 . . . . 45.43 110.482 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 44.33 37.4 1.97 Allowed 'General case' 0 C--N 1.351 0.646 0 C-N-CA 126.214 1.805 . . . . 73.33 109.912 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.31 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.21 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.34 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.34 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.14 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.02 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 63.32 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.15 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.23 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.43 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 64.24 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.01 111.845 -176.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.35 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 65.54 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.01 109.286 172.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.426 HD11 HD23 ' A' ' 34' ' ' LEU . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.45 109.191 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.35 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.44 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.35 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.801 HD13 ' HB2' ' A' ' 29' ' ' ALA . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.42 110.923 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.11 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.33 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.23 111.687 163.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.01 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.41 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.44 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.801 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.23 114.317 -170.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.14 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.44 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' HB1' ' A' ' 29' ' ' ALA . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 72.15 111.674 -167.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 72.23 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD22 ' H ' ' A' ' 35' ' ' MET . 1.7 tm? -84.14 159.31 21.1 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.22 109.986 172.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.651 ' H ' HD22 ' A' ' 34' ' ' LEU . 66.6 mtp -46.18 77.17 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 131.456 3.903 . . . . 71.44 114.479 170.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.5 mtp180 -131.18 -67.04 0.72 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 108.428 -0.952 . . . . 72.34 108.428 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.51 116.25 5.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.646 1.178 . . . . 72.53 108.705 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.7 -23.74 29.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.519 0.933 . . . . 63.51 113.519 171.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.6 t -86.17 -24.29 26.2 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.488 1.04 . . . . 70.21 111.5 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -81.0 -63.47 1.4 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.048 -1.032 . . . . 71.25 110.356 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 131.96 2.63 4.22 Favored Glycine 0 N--CA 1.466 0.659 0 CA-C-O 119.868 -0.407 . . . . 70.03 113.136 -165.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -69.58 14.45 0.1 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.849 1.659 . . . . 42.03 111.906 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 p -133.7 98.72 4.26 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.44 1.896 . . . . 74.24 111.124 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.53 13.34 0.64 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 70.15 114.928 -176.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.42 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.43 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 50.44 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 70.31 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.44 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.2 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.1 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.54 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.33 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 64.32 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 64.3 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.11 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 52.44 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.21 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.14 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.13 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.44 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 64.23 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.41 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 71.03 113.073 168.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 51.3 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.4 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 51.45 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 70.33 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 65.44 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 65.25 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.43 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 51.33 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.32 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.14 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 65.32 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.05 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.13 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.02 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.2 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t -142.97 171.67 13.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.2 107.064 173.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -129.28 150.82 76.57 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.174 -1.417 . . . . 73.31 107.174 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.95 -25.01 20.19 Favored 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.114 1.876 . . . . 74.34 114.856 -160.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 84' ' ' PRO . 8.8 ptmt 60.99 163.35 0.1 Allowed Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 130.223 3.409 . . . . 65.44 113.193 -170.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.445 ' O ' ' HE2' ' A' ' 83' ' ' LYS . 56.2 Cg_endo -71.67 103.52 1.46 Allowed 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.089 1.86 . . . . 74.54 108.145 166.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -89.97 62.89 5.77 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 123.353 1.549 . . . . 44.22 110.0 -170.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.3 mm -93.57 164.97 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.071 -1.455 . . . . 63.5 107.071 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -80.64 135.0 35.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.998 -1.482 . . . . 61.11 106.998 161.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 44.07 56.91 4.49 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 127.523 2.329 . . . . 72.15 111.901 158.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -78.59 -4.67 49.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 113.569 -1.651 . . . . 73.43 113.342 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 36.3 p-90 -123.71 9.88 8.95 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 128.151 2.58 . . . . 72.31 111.353 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.253 1.279 0 N-CA-C 104.214 -2.513 . . . . 74.23 104.214 161.395 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 111.804 0.298 . . . . 64.13 111.804 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -135.56 22.73 3.4 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.459 1.504 . . . . 73.34 110.624 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 64.55 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.45 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 64.43 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.31 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.451 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.42 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.15 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.14 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.12 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 51.43 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.12 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 73.35 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.51 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' HD22 ' A' ' 34' ' ' LEU . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 64.43 109.719 172.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.44 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.34 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 65.14 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 64.42 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 61.23 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 72.31 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 62.42 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 53.41 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.24 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.55 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.02 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.52 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.403 ' NE2' ' H ' ' A' ' 28' ' ' GLN . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 72.34 107.224 167.013 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 65.31 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 74.25 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.42 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 71.45 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.03 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.589 HD23 ' N ' ' A' ' 35' ' ' MET . 4.7 tt -109.22 -173.86 2.37 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 63.55 108.766 164.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.589 ' N ' HD23 ' A' ' 34' ' ' LEU . 30.3 mtp -48.19 130.97 16.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.938 2.095 . . . . 75.32 110.354 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.87 -56.79 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.983 2.513 . . . . 63.25 108.327 171.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -77.27 -11.54 59.84 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.041 -0.981 . . . . 64.32 112.577 -159.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.322 0.0 OUTLIER 44.39 -66.82 0.0 OUTLIER 'General case' 0 C--N 1.345 0.398 0 C-N-CA 130.867 3.667 . . . . 73.21 114.267 -170.554 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.6 t -60.98 -54.05 49.76 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.093 2.557 . . . . 75.31 110.032 -166.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 t -55.15 -35.72 65.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.955 0.502 . . . . 75.42 111.991 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 123.89 7.2 6.76 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 118.412 0.551 . . . . 64.23 113.202 167.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -64.69 14.28 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.03 2.132 . . . . 75.32 112.599 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.0 t -140.91 85.43 1.99 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.824 2.05 . . . . 54.15 105.942 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -145.17 7.92 1.19 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.182 2.193 . . . . 72.51 110.958 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.33 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 52.12 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 72.41 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.43 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.42 105.693 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.24 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.41 111.813 -164.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.14 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.05 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 63.11 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.31 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.21 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.52 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 63.12 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.54 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 72.43 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.415 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 53.34 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.15 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.04 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.35 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 65.52 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.41 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 72.12 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 70.23 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.42 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 70.45 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.23 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.21 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.11 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 54.21 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 64.22 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.41 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.451 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 62.24 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 73.41 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -88.13 57.17 4.16 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 62.52 108.767 171.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -49.87 154.73 1.72 Allowed Pre-proline 0 N--CA 1.471 0.579 0 C-N-CA 124.238 1.015 . . . . 64.35 112.246 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -66.25 -39.63 17.26 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 121.459 1.439 . . . . 65.22 110.473 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.406 ' HE3' ' HD2' ' A' ' 85' ' ' LYS . 28.9 pttt 55.77 165.79 0.06 OUTLIER Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 128.635 2.774 . . . . 73.54 112.693 -171.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.47 101.73 0.45 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 N-CA-C 108.029 -1.566 . . . . 65.31 108.029 165.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 5.0 tptm -105.67 17.25 24.07 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.977 1.711 . . . . 72.23 111.701 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.4 mp -71.14 166.49 2.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 125.649 1.58 . . . . 72.14 107.889 -176.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -162.02 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.735 1.214 . . . . 63.25 110.663 158.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 117.56 5.63 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 119.798 -1.814 . . . . 65.35 110.432 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.86 -0.91 29.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.145 2.178 . . . . 74.42 112.91 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -122.14 6.84 9.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.831 1.652 . . . . 74.35 111.522 176.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.25 1.087 0 N-CA-C 105.746 -1.946 . . . . 74.45 105.746 163.563 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 118.51 -0.757 . . . . 73.02 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -122.21 1.2 9.68 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.582 1.953 . . . . 71.12 113.275 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 70.1 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 73.21 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.31 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.34 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 71.33 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.43 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.32 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.34 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.13 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 51.43 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 71.32 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.11 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 63.54 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.23 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.31 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 72.22 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.52 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 64.31 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.4 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 71.31 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.4 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.51 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HG22 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 51.34 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.34 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.32 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.21 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.2 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.15 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.32 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.41 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 35' ' ' MET . 2.2 tm? -91.5 167.85 11.95 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 73.3 107.986 173.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.495 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.0 mpp? -55.25 16.96 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.861 2.864 . . . . 63.43 117.382 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.7 mtp85 -130.02 105.11 7.74 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.114 -1.617 . . . . 70.24 108.724 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -154.04 135.18 13.97 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.862 1.265 . . . . 72.54 111.096 168.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -52.79 -51.36 61.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.231 1.413 . . . . 74.41 110.888 170.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -23.21 65.46 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 115.727 1.751 . . . . 42.12 115.727 -168.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.3 -25.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.243 0.929 . . . . 63.34 112.872 -177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.76 -27.07 12.67 Favored Glycine 0 C--O 1.225 -0.434 0 CA-C-O 118.796 -1.002 . . . . 71.11 112.015 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 45.84 31.75 1.12 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.985 2.514 . . . . 72.23 113.107 -175.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -115.64 97.93 6.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.662 1.585 . . . . 74.31 110.716 -150.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 -148.46 -5.09 0.44 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.34 115.296 -176.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 43.33 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.23 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.42 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 65.33 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.43 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.43 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 72.4 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.3 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 73.13 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.41 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 72.52 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.33 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.2 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.32 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 74.54 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.22 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 62.22 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.3 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.02 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.1 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.04 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.34 114.908 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 62.22 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 71.34 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.21 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 63.12 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 53.43 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 25.5 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.43 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.04 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.2 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.42 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 52.52 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.2 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.33 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t -84.03 70.64 10.51 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.22 108.148 173.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.52 163.5 14.85 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 112.903 0.705 . . . . 73.02 112.903 -168.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.74 -24.94 9.73 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 121.414 1.409 . . . . 62.41 113.214 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 42.8 pttt 54.13 165.84 0.05 OUTLIER Pre-proline 0 C--N 1.343 0.3 0 C-N-CA 129.736 3.214 . . . . 74.14 115.264 -173.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.46 105.41 1.06 Allowed 'Trans proline' 0 N--CA 1.444 -1.404 0 N-CA-C 107.363 -1.822 . . . . 65.32 107.363 159.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -112.79 21.55 15.41 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.815 1.246 . . . . 71.24 110.991 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.521 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.1 mp -72.52 144.44 13.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.121 -1.066 . . . . 74.14 108.121 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.02 113.97 8.6 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.611 -1.255 . . . . 70.55 107.611 169.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.88 67.38 0.75 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 128.789 2.836 . . . . 72.01 114.253 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.73 -24.82 67.88 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.922 1.289 . . . . 71.33 113.736 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 68.8 p-90 -106.2 4.79 29.3 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 121.337 -0.852 . . . . 72.41 113.262 -174.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.243 0.738 0 N-CA-C 107.247 -1.39 . . . . 64.24 107.247 163.065 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.643 -0.694 . . . . 71.31 110.137 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -132.37 28.43 4.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.04 0.837 . . . . 70.32 111.271 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 63.12 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 62.02 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.54 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 61.44 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 63.54 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 61.34 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 35.34 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.51 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.21 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.41 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 50.22 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.583 ' N ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.45 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.32 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.04 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 64.41 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HA ' HD21 ' A' ' 22' ' ' LEU . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.12 113.122 -169.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 41.25 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.24 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.634 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.21 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 64.44 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.02 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.51 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 62.42 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.754 HG11 ' CE2' ' A' ' 51' ' ' PHE . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.01 109.439 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.04 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.626 ' H ' HG12 ' A' ' 27' ' ' VAL . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 43.41 112.137 -146.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.24 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.01 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 70.01 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.21 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -64.43 -153.63 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.12 111.624 173.264 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.304 0.8 OUTLIER -94.49 -70.51 0.7 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.807 1.781 . . . . 63.31 115.807 166.497 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -68.56 104.98 2.09 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 124.076 1.893 . . . . 63.01 111.567 -169.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -159.56 156.7 28.52 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 111.834 -2.439 . . . . 64.41 107.063 177.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.02 -25.48 2.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.666 -0.683 . . . . 73.14 112.49 165.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 t -68.93 -33.95 74.57 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 123.334 0.396 . . . . 62.3 110.555 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.1 m -107.45 -28.82 9.59 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.231 1.197 . . . . 71.3 114.231 -162.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.89 11.64 20.28 Favored Glycine 0 C--N 1.34 0.759 0 C-N-CA 123.797 0.713 . . . . 74.32 113.088 167.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -73.32 -174.76 1.7 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 117.348 0.574 . . . . 72.41 111.449 -173.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 77.64 97.01 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 129.376 3.07 . . . . 63.04 113.51 -172.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -137.87 -3.77 1.81 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.423 1.889 . . . . 51.33 114.426 171.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.22 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.22 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 61.22 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 74.14 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.452 HG11 ' CZ3' ' A' ' 60' ' ' TRP . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.34 107.464 174.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.41 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.754 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 71.41 109.604 -178.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.24 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.44 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.11 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.34 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 24.02 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.42 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.34 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TRP . . . . . 0.634 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 61.15 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.35 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.21 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 71.32 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.45 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.11 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 54.23 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 34.52 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 34.33 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.35 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 52.04 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 35.11 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.54 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 74.15 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 72.44 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.33 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 63.55 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.24 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.42 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 54.87 1.73 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.14 112.752 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.68 156.69 4.45 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 123.759 0.824 . . . . 51.35 111.068 177.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.1 -24.83 14.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.761 2.308 . . . . 72.1 114.209 -161.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -158.48 162.22 27.12 Favored Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 126.43 1.892 . . . . 72.44 108.69 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.28 105.21 1.53 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.471 2.114 . . . . 72.31 107.562 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -120.38 55.91 1.0 Allowed 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.89 1.276 . . . . 74.03 110.814 -169.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.541 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -87.34 155.51 3.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.672 1.989 . . . . 70.44 107.737 171.528 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -71.26 137.3 48.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 106.352 -1.722 . . . . 73.12 106.352 159.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 45.32 56.07 5.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.291 1.519 . . . . 44.43 113.902 156.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.85 -3.32 9.25 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.065 1.746 . . . . 41.14 112.92 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -119.23 6.42 11.22 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.599 1.96 . . . . 73.1 111.9 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.251 1.137 0 N-CA-C 106.543 -1.651 . . . . 74.42 106.543 171.305 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 108.56 -0.904 . . . . 53.22 108.56 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.79 18.43 6.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.352 0.978 . . . . 74.13 112.51 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.409 HG12 ' CB ' ' A' ' 50' ' ' GLU . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.32 105.884 -176.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 72.02 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.34 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.41 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.12 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.3 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.541 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.01 111.236 -175.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 12' ' ' ALA . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.43 112.406 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 74.21 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 10' ' ' PRO . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.52 114.188 -170.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 72.51 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 55.42 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.2 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 63.1 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.54 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.494 ' CD1' HD23 ' A' ' 34' ' ' LEU . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 72.13 109.416 172.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 71.53 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.13 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.52 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.11 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.32 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.22 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.34 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 54.41 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 73.1 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.53 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.1 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.3 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.44 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 63.43 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.05 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.494 HD23 ' CD1' ' A' ' 18' ' ' ILE . 1.3 tm? -76.39 163.21 27.19 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.3 109.638 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.476 ' H ' HD22 ' A' ' 34' ' ' LEU . 20.6 mtp -59.4 14.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 129.724 3.209 . . . . 72.05 116.046 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -139.94 132.76 29.15 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 126.045 1.738 . . . . 75.42 108.332 171.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -162.58 -47.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.152 0.981 . . . . 75.22 113.326 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.08 7.35 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 118.347 2.721 . . . . 75.44 118.347 -169.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -121.41 -16.89 7.74 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 127.889 2.476 . . . . 74.42 111.634 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.8 t -126.7 -31.54 2.69 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.159 1.345 . . . . 61.42 113.539 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.88 21.25 12.37 Favored Glycine 0 N--CA 1.473 1.134 0 CA-C-N 119.057 0.844 . . . . 73.11 112.875 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -67.8 118.92 11.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.813 1.245 . . . . 75.04 108.377 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p 174.76 141.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 129.667 3.187 . . . . 61.32 106.523 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 173.86 0.37 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.441 2.696 . . . . 71.12 115.026 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.12 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.42 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.541 ' HB2' ' CD2' ' A' ' 9' ' ' LEU . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.41 109.247 -176.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 72.03 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 52.53 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CB ' HG12 ' A' ' 3' ' ' ILE 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 71.13 113.14 164.45 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.23 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.34 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.21 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 65.23 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 62.22 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.34 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.2 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.31 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.32 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.11 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.23 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.22 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.1 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 52.44 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.34 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 70.01 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.54 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.44 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.3 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.3 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.3 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 53.44 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.42 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.1 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 63.4 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.41 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.44 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.42 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.98 84.21 1.25 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.34 108.469 158.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.82 156.96 91.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 O-C-N 120.686 -1.259 . . . . 71.21 112.47 -175.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -68.57 -46.44 1.89 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.744 1.629 . . . . 61.24 113.966 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -160.6 154.24 18.87 Favored Pre-proline 0 C--O 1.238 0.478 0 N-CA-C 105.342 -2.096 . . . . 72.11 105.342 165.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.56 101.29 0.2 Allowed 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.056 2.504 . . . . 74.34 110.134 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -100.24 17.48 21.23 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.029 1.332 . . . . 72.1 111.363 -177.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.589 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.4 mp -72.68 166.4 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 125.301 1.441 . . . . 63.32 107.715 176.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 47.5 m-20 -58.24 -176.25 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.861 1.264 . . . . 71.44 109.846 165.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.17 112.63 0.43 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.784 2.434 . . . . 74.42 109.097 177.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -68.38 -9.17 46.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.326 0.65 . . . . 64.13 112.417 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 32.4 p-90 -117.03 5.9 12.87 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 127.187 2.195 . . . . 72.3 110.823 -170.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.253 1.285 0 N-CA-C 104.608 -2.367 . . . . 74.31 104.608 162.737 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -132.19 -4.76 3.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.871 1.214 . . . . 71.54 112.001 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.41 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 72.43 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.45 ' C ' HD22 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.4 109.861 166.252 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.461 HD21 ' CZ3' ' A' ' 60' ' ' TRP . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.12 108.548 -168.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 60.54 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.24 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.41 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.32 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 72.11 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 71.53 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.21 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.14 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.21 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 55.24 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.524 ' HA ' HD12 ' A' ' 22' ' ' LEU . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.42 110.126 173.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.41 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 63.41 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' ' 29' ' ' ALA . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.53 108.26 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 55.24 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 64.32 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.52 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.24 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.506 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 72.31 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.689 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.32 115.227 -165.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.41 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.4 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.11 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.21 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -107.65 -172.47 2.08 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.42 113.333 -175.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.716 ' H ' HD22 ' A' ' 34' ' ' LEU . 70.6 mtp -67.7 -9.98 48.4 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.22 1.933 . . . . 72.3 116.22 -162.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -44.07 -58.03 3.05 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.965 2.106 . . . . 72.14 111.053 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.66 70.72 1.86 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 126.422 1.889 . . . . 55.01 113.525 -163.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 -0.07 5.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 120.368 -1.458 . . . . 75.13 114.107 -166.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 m -104.34 -45.4 4.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.875 0.762 . . . . 75.41 109.78 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.2 t -58.73 -33.36 70.14 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.432 1.014 . . . . 62.32 110.885 174.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.62 51.99 3.68 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 107.903 -2.079 . . . . 71.31 107.903 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -90.29 22.61 3.26 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.097 -1.075 . . . . 55.1 108.097 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 p -136.02 94.92 3.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.912 2.085 . . . . 75.22 111.036 -163.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.66 -71.36 0.59 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 127.441 2.296 . . . . 71.12 108.242 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.32 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 54.44 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.42 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.12 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.54 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.32 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.43 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 41.23 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.5 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 52.12 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 73.14 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 64.21 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 73.33 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 61.24 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 55.23 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.15 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.31 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.13 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.21 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.32 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 71.31 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 61.42 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.32 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 72.54 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.44 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.13 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.32 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.55 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.55 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.41 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.15 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.23 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.54 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 72.13 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 71.13 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -129.01 54.53 1.79 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.22 106.984 176.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.43 154.96 61.29 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 111.721 0.267 . . . . 72.42 111.721 -167.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.09 -18.88 23.51 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.763 0.976 . . . . 75.54 114.212 -166.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 pttt 59.11 166.17 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 128.345 2.658 . . . . 71.4 113.364 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.62 105.67 0.95 Allowed 'Trans proline' 0 N--CA 1.447 -1.227 0 N-CA-C 106.889 -2.004 . . . . 41.41 106.889 161.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -118.17 24.04 11.22 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 122.19 0.995 . . . . 75.34 109.788 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.777 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.9 OUTLIER -74.87 154.0 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 105.835 -1.913 . . . . 75.04 105.835 166.225 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -74.06 -5.88 44.21 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.827 1.047 . . . . 71.23 113.827 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -136.96 113.13 9.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 107.537 -1.282 . . . . 64.2 107.537 -171.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 1.64 41.41 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.692 -1.594 . . . . 71.42 111.99 -176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -129.59 0.24 4.96 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.849 2.06 . . . . 73.1 112.208 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--O 1.254 1.316 0 C-N-CA 123.9 0.88 . . . . 63.11 108.882 170.736 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 109.395 -0.594 . . . . 72.33 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -144.9 26.72 1.35 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.669 1.987 . . . . 73.44 108.636 -176.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 63.14 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 60.15 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.42 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 71.41 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 73.41 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.35 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 51.04 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.51 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.11 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.22 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.12 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.43 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.55 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 71.55 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 73.33 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 22' ' ' LEU . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.04 107.017 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.33 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.11 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 63.54 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.843 HD13 ' HB2' ' A' ' 29' ' ' ALA . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 71.32 109.068 -177.183 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 61.55 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 63.45 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.13 112.971 174.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 54.23 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 71.52 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.554 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.54 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.843 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.31 109.937 -157.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.41 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 73.23 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 61.32 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.14 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.702 HD22 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -129.71 -154.48 0.64 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 54.05 108.261 175.573 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.702 ' H ' HD22 ' A' ' 34' ' ' LEU . 5.7 mtp -68.94 69.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 129.002 2.921 . . . . 74.54 114.05 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -143.63 -35.12 0.39 Allowed 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 118.545 -0.741 . . . . 74.34 111.764 -164.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -77.12 -45.69 26.05 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 119.834 1.197 . . . . 73.34 108.586 -172.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 47.06 -7.74 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 1 C-N-CA 132.296 4.238 . . . . 74.11 115.962 -154.095 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.78 -17.18 18.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 118.248 -0.882 . . . . 75.55 112.897 -165.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.5 t -131.27 -26.74 2.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.73 1.15 . . . . 52.03 113.311 -162.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.73 -2.71 2.22 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 115.732 1.053 . . . . 63.54 115.732 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -75.42 11.03 1.36 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.228 1.514 . . . . 63.54 114.151 -160.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HA ' ' A' ' 35' ' ' MET . 3.6 p -131.88 105.41 7.43 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 125.389 1.476 . . . . 73.32 111.338 -173.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -153.52 9.69 0.41 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 64.15 114.351 175.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.15 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 72.45 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.485 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.13 110.517 -177.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 74.13 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 44.23 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.35 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.614 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.23 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.41 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 62.13 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.33 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.41 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.34 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.43 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 61.54 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.23 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.54 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.23 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 64.33 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 35.4 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.33 111.355 -176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 72.12 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 73.11 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.53 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.22 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.45 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.432 HD12 HG21 ' A' ' 75' ' ' VAL . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 74.22 106.392 -166.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 73.34 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.22 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.21 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.432 HG21 HD12 ' A' ' 70' ' ' ILE . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 62.21 106.688 168.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.55 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 73.43 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.44 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.53 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.32 72.3 10.36 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 72.15 106.127 163.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.26 144.61 69.91 Favored Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 121.206 -0.934 . . . . 61.33 111.053 -171.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.69 -22.74 20.25 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.922 1.748 . . . . 54.05 112.982 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.272 11.2 ptpt 54.27 163.91 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 131.224 3.809 . . . . 71.34 114.451 -172.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.52 100.82 0.5 Allowed 'Trans proline' 0 N--CA 1.443 -1.452 0 N-CA-C 107.438 -1.793 . . . . 55.33 107.438 158.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.94 22.43 13.94 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.138 1.375 . . . . 73.13 108.312 173.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.597 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.9 mp -64.29 137.17 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 N-CA-C 104.34 -2.467 . . . . 64.45 104.34 160.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.02 -3.11 20.96 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.524 0.935 . . . . 74.23 113.524 -178.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -136.21 168.02 20.18 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.445 1.898 . . . . 62.12 109.33 175.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.81 -1.52 7.27 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.849 0.859 . . . . 75.15 112.581 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -111.56 5.44 19.43 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.02 2.128 . . . . 73.25 111.381 171.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.249 1.034 0 C-N-CA 124.174 0.989 . . . . 75.44 109.909 172.792 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.9 t . . . . . 0 CA--C 1.514 -0.409 0 CA-C-O 122.323 1.059 . . . . 40.32 108.944 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -137.06 1.02 2.43 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 130.03 3.332 . . . . 74.33 108.135 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 53.34 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 61.45 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 63.23 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 61.14 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.42 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.42 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.03 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 55.44 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 41.31 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.31 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.11 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.41 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.14 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 62.31 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.22 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 64.15 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 72.15 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 62.15 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.565 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 64.02 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.15 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 72.02 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 55.51 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.03 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.02 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.04 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.42 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 62.35 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.13 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.12 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.35 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD13 ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -111.5 -153.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.12 106.352 166.023 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.569 ' H ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER 55.13 -176.49 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.236 1 C-N-CA 132.133 4.173 . . . . 75.43 110.222 -169.043 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.8 140.08 29.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 106.799 -1.556 . . . . 73.14 106.799 168.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -161.12 98.03 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.668 0.387 . . . . 64.43 111.35 170.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -11.5 40.96 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.894 1.442 . . . . 64.35 114.894 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -93.06 -13.63 28.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.497 1.119 . . . . 64.22 111.139 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -123.6 -42.04 2.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 120.363 1.438 . . . . 42.51 112.164 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.38 16.09 3.95 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 123.813 0.72 . . . . 72.13 113.303 172.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -85.71 173.72 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 117.96 0.88 . . . . 75.15 109.712 -173.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.0 p 75.33 88.45 0.09 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 130.807 3.643 . . . . 72.21 110.42 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -132.86 -0.48 3.43 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.547 -0.752 . . . . 74.21 112.118 -173.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.21 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.15 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.24 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.21 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 61.12 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.32 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.21 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.24 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 54.51 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 60.11 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.43 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.45 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 53.35 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.05 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.42 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TRP . . . . . 0.565 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.33 111.454 176.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.43 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.25 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 60.25 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.45 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 62.44 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.43 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 63.03 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 72.33 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.05 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 71.45 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 73.03 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 71.42 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 62.32 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 63.41 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 72.12 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 53.55 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.41 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 53.41 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.15 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.65 60.04 5.86 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 54.45 108.024 172.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.7 153.91 38.86 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.191 0.996 . . . . 75.3 111.565 -172.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -72.6 -40.72 1.94 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.887 1.725 . . . . 64.21 111.824 -164.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -159.34 146.12 12.61 Favored Pre-proline 0 N--CA 1.444 -0.734 0 C-N-CA 126.991 2.117 . . . . 71.4 106.567 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.99 105.34 0.66 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 C-N-CA 123.145 2.563 . . . . 74.03 107.617 175.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -118.84 43.84 2.45 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.281 1.832 . . . . 75.14 111.235 -167.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.619 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.5 mp -57.36 156.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 106.872 -1.529 . . . . 75.4 106.872 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 -64.68 -154.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.564 1.145 . . . . 72.02 108.224 162.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.646 ' HB2' HD13 ' A' ' 91' ' ' LEU . 55.7 mm-40 -57.88 132.56 53.75 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 119.97 -1.706 . . . . 75.4 109.344 173.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.23 -3.08 5.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.704 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.1 p-90 -128.84 -5.51 5.1 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.421 1.088 . . . . 75.2 112.887 -174.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.646 HD13 ' HB2' ' A' ' 88' ' ' GLU 0.559 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 113.222 0.823 . . . . 74.43 113.222 168.721 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.451 ' HB2' ' CD2' ' A' ' 79' ' ' TYR . 1.5 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.774 -0.454 . . . . 70.15 109.774 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -126.07 12.57 7.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.392 2.277 . . . . 73.32 111.461 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 73.21 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 52.34 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.44 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 61.3 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.41 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.23 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.42 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.14 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.24 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.03 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.35 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.01 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.44 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.42 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 22' ' ' LEU . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.32 110.744 176.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 73.21 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.3 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 29' ' ' ALA . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 64.1 109.813 172.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 63.43 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.52 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.14 111.423 176.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.13 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.03 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.23 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.508 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.42 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.35 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 60.41 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 72.45 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.765 HD13 ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -71.7 -154.17 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 63.34 109.341 171.823 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.765 ' H ' HD13 ' A' ' 34' ' ' LEU . 1.4 mtm -94.9 -164.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 127.421 2.288 . . . . 64.25 105.863 168.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtp85 68.84 -5.04 1.06 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 127.562 2.345 . . . . 73.33 116.736 167.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.73 -26.72 63.51 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.672 0.99 . . . . 75.23 113.672 -161.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 47.29 -15.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 129.897 3.279 . . . . 51.21 118.459 -169.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.3 p -103.92 -6.25 21.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 120.028 1.285 . . . . 75.13 113.702 -167.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 p -146.92 -7.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.778 1.399 . . . . 74.14 114.778 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.42 27.91 37.97 Favored Glycine 0 C--N 1.337 0.618 0 O-C-N 120.25 -1.531 . . . . 41.23 110.861 168.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -60.27 -173.3 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.154 1.782 . . . . 73.23 109.427 164.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.404 ' HB2' ' SD ' ' A' ' 35' ' ' MET . 1.2 p 77.03 137.31 0.06 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.749 2.42 . . . . 72.22 111.926 -167.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -167.98 15.98 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.71 2.404 . . . . 75.21 111.988 165.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.11 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.15 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 53.41 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.11 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 51.12 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.35 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 61.31 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 63.35 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.33 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.41 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.45 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.23 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.13 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.24 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.24 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.01 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.23 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.01 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.44 110.778 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.24 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 63.3 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.1 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 63.13 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 61.4 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.2 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 60.2 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.3 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.12 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 64.41 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 53.21 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.34 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 71.01 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 64.8 m80 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 71.25 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.451 ' CD2' ' HB2' ' A' ' 1' ' ' SER . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.23 106.521 162.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -128.99 52.26 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.41 107.689 -172.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.31 154.41 8.35 Favored Pre-proline 0 C--O 1.233 0.222 0 C-N-CA 123.9 0.88 . . . . 74.43 112.232 -165.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -69.93 -28.66 24.16 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 120.044 0.496 . . . . 75.32 113.123 -172.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HB2' ' HD2' ' A' ' 84' ' ' PRO 0.266 12.7 ptpt 54.79 164.47 0.05 OUTLIER Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 131.32 3.848 . . . . 73.24 113.334 -175.475 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 75.9 Cg_endo -67.76 106.03 1.22 Allowed 'Trans proline' 0 N--CA 1.443 -1.491 0 N-CA-C 106.987 -1.966 . . . . 61.33 106.987 164.211 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -105.37 14.27 29.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.021 1.329 . . . . 75.23 111.414 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.7 mp -67.28 147.45 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 122.297 1.046 . . . . 64.04 108.531 -169.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -5.07 26.88 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.745 1.017 . . . . 75.13 113.745 172.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.434 ' H ' HG22 ' A' ' 86' ' ' ILE . 9.9 mt-10 -134.41 90.98 2.73 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 129.665 3.186 . . . . 63.14 104.758 -174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.93 -10.21 31.79 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.726 -0.608 . . . . 75.44 112.165 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -123.32 6.44 9.06 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.69 1.996 . . . . 73.03 112.662 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.246 0.892 0 N-CA-C 106.839 -1.541 . . . . 73.31 106.839 169.86 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.466 0.335 0 N-CA-C 108.076 -1.083 . . . . 72.32 108.076 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -125.22 9.21 7.95 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 62.24 111.412 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 64.41 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 ' HB ' ' A' ' 49' ' ' VAL 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.1 115.764 172.695 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 50.14 108.58 167.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.615 HD11 ' HH2' ' A' ' 60' ' ' TRP . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 71.34 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.21 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 62.12 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.35 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.44 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 70.15 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.5 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 45.55 112.57 -170.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 71.13 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.43 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.02 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 45.55 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 64.24 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HA ' HD12 ' A' ' 22' ' ' LEU . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 50.33 111.055 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.43 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.13 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.746 HD13 ' CB ' ' A' ' 29' ' ' ALA . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 71.23 109.809 -178.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 62.45 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.22 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 54.51 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.14 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 44.44 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.23 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.746 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 50.41 112.892 -164.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 73.3 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 70.33 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.41 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.03 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 35' ' ' MET . 0.2 OUTLIER -77.29 -174.48 3.28 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 72.22 110.813 -179.084 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.763 ' H ' HD13 ' A' ' 34' ' ' LEU . 3.0 ttp -88.4 -0.87 57.66 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.823 2.049 . . . . 74.14 112.269 -174.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mtp85 -119.26 113.15 20.41 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 104.959 -2.237 . . . . 74.01 104.959 171.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -166.45 87.12 0.33 Allowed 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.97 0.908 . . . . 70.41 110.947 175.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -28.33 23.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.572 0.952 . . . . 74.2 113.572 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -89.53 2.99 53.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.473 0.916 . . . . 74.12 113.473 -174.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.9 t -152.64 -14.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.658 1.572 . . . . 44.43 112.446 -176.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.68 77.54 Favored Glycine 0 C--N 1.342 0.914 0 O-C-N 119.722 -1.861 . . . . 73.1 110.86 170.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -63.32 114.63 3.95 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 126.448 1.899 . . . . 71.04 108.149 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.8 t 178.49 145.15 0.13 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 128.803 2.841 . . . . 70.23 108.062 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 174.88 -42.5 0.01 OUTLIER 'General case' 0 C--N 1.346 0.417 0 C-N-CA 127.658 2.383 . . . . 71.34 111.622 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 62.45 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 52.32 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 54.4 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.43 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.682 ' HB ' HG13 ' A' ' 4' ' ' VAL . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 54.11 106.981 168.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.23 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 61.2 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 62.13 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.43 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.22 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.03 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.1 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 63.32 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.1 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TRP . . . . . 0.615 ' HH2' HD11 ' A' ' 6' ' ' LEU . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 70.41 113.543 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.1 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.43 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.02 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 52.14 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 65.44 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.4 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 63.24 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.05 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.03 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.488 HG22 ' HG ' ' A' ' 71' ' ' LEU . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 63.34 108.541 -177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.488 ' HG ' HG22 ' A' ' 70' ' ' ILE . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 71.24 111.689 -175.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.31 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.15 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 72.01 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 54.12 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.24 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.467 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 54.4 110.078 165.681 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 60.3 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 73.42 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 1.9 t -88.97 63.95 6.95 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.43 108.125 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.4 p-10 -61.44 149.66 82.91 Favored Pre-proline 0 CA--C 1.541 0.618 0 O-C-N 121.705 -0.622 . . . . 61.01 110.645 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -67.71 -55.06 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.689 2.259 . . . . 74.12 110.034 -172.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -122.13 153.02 61.11 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 125.021 1.328 . . . . 63.14 108.081 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.73 106.67 0.95 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 122.697 2.265 . . . . 52.22 108.881 168.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -104.76 20.26 19.0 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.481 -0.762 . . . . 74.33 112.664 167.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.6 mp -66.58 165.27 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 107.476 -1.305 . . . . 71.04 107.476 171.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -102.04 146.79 27.4 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.801 2.04 . . . . 75.14 106.861 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 44.37 64.71 1.23 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 127.32 2.248 . . . . 73.02 111.248 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.09 -28.27 39.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.626 -1.17 . . . . 75.41 111.402 -178.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 27.6 p-90 -95.94 -5.45 41.34 Favored 'General case' 0 CA--C 1.521 -0.153 0 N-CA-C 113.452 0.908 . . . . 75.4 113.452 -173.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.244 0.813 0 N-CA-C 107.442 -1.318 . . . . 74.42 107.442 179.498 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 N--CA 1.472 0.663 0 CA-C-O 121.082 0.467 . . . . 64.45 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -151.53 12.85 0.63 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.878 1.671 . . . . 73.42 111.649 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.34 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.32 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.44 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 65.44 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.12 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.24 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.43 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.4 108.453 167.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.22 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 44.31 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 62.11 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 43.43 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 73.34 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.41 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.12 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 22' ' ' LEU . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 61.53 107.56 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 61.3 110.313 -174.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 74.34 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 71.3 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.836 HD13 ' CB ' ' A' ' 29' ' ' ALA . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 71.32 108.108 172.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.33 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.21 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 54.3 107.361 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.23 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.452 ' CG1' ' CE2' ' A' ' 51' ' ' PHE . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 54.21 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.836 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.12 113.776 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 74.4 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.13 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.412 HG11 HD12 ' A' ' 18' ' ' ILE . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.43 108.25 173.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.13 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.789 HD22 ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -76.85 -170.06 1.49 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.12 110.408 -176.226 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.789 ' H ' HD22 ' A' ' 34' ' ' LEU . 1.1 mtp -75.57 147.05 39.96 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 120.692 -1.255 . . . . 64.42 108.284 164.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 66.02 135.78 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.999 1.72 . . . . 75.33 110.787 -172.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -165.97 -42.76 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 113.376 -1.738 . . . . 73.03 111.459 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 55.42 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 1 C-N-CA 131.912 4.085 . . . . 55.32 117.269 -166.914 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.17 -44.66 12.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 124.402 1.081 . . . . 74.44 110.247 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.6 m -115.18 -2.74 12.65 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.459 1.281 . . . . 75.03 114.459 177.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.08 8.21 75.88 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.997 1.271 . . . . 61.33 112.123 161.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -56.71 127.1 29.85 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 128.156 2.582 . . . . 74.41 109.875 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 89.4 p -173.1 179.57 2.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.435 2.294 . . . . 74.53 111.418 161.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 174.73 -35.01 0.0 OUTLIER 'General case' 0 C--N 1.345 0.407 0 C-N-CA 129.619 3.167 . . . . 74.2 111.481 166.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.34 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 70.53 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 44.24 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.21 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 45.5 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 72.25 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 70.12 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.55 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.02 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.406 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.35 113.542 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.34 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.12 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.13 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 65.23 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 73.41 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.21 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.22 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.54 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 51.44 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.24 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.3 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 72.1 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.14 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 62.24 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 64.21 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 71.54 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 60.12 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.44 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.13 108.253 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 72.43 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.4 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 70.53 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 64.24 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.13 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 70.54 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.59 77.59 0.18 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.14 105.516 153.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.28 161.9 37.44 Favored Pre-proline 0 CA--C 1.541 0.624 0 O-C-N 120.998 -1.064 . . . . 74.15 109.108 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.17 -33.58 3.41 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 CA-C-N 120.372 1.169 . . . . 54.13 113.129 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HB2' ' HD2' ' A' ' 84' ' ' PRO 0.29 14.3 ptpt 54.43 165.95 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 129.526 3.13 . . . . 65.31 113.876 -170.578 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.456 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 70.0 Cg_endo -65.94 105.6 0.84 Allowed 'Trans proline' 0 N--CA 1.445 -1.327 0 N-CA-C 106.458 -2.17 . . . . 73.12 106.458 159.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -114.0 17.22 17.99 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.745 1.218 . . . . 62.23 112.717 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.495 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.2 mp -78.83 165.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 125.955 1.702 . . . . 72.31 108.872 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.43 -6.03 9.28 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.88 1.067 . . . . 71.25 113.88 162.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -120.09 103.13 9.02 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 126.686 1.994 . . . . 51.21 107.183 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.62 -6.12 9.71 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.266 1.427 . . . . 64.04 110.9 -174.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 33.8 p-90 -136.42 10.11 3.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.972 2.109 . . . . 74.43 110.719 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.068 1.747 . . . . 71.15 108.597 176.462 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 121.852 0.834 . . . . 64.45 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -135.16 12.88 3.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 128.399 2.68 . . . . 62.01 110.003 163.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.33 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.12 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 72.21 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 72.13 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.24 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.12 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 60.24 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.14 110.749 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.12 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 51.31 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.426 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.31 111.669 -167.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.43 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.499 ' H ' ' HG2' ' A' ' 35' ' ' MET . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.42 110.348 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 43.54 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.22 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.11 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.12 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 14.2 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 73.12 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.541 ' CD1' ' HB2' ' A' ' 29' ' ' ALA . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 65.41 109.365 168.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.33 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.11 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.22 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 53.34 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 61.15 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.15 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 64.11 109.168 152.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.42 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.3 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 51.54 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.14 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD13 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -131.71 -153.39 0.55 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.03 106.983 169.494 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.499 ' HG2' ' H ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER 57.05 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.75 1 C-N-CA 132.34 4.256 . . . . 74.43 110.346 -165.901 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.452 ' HA ' ' HB3' ' A' ' 43' ' ' SER . 0.1 OUTLIER 172.9 155.62 0.1 Allowed 'General case' 0 CA--C 1.502 -0.903 0 C-N-CA 127.1 2.16 . . . . 74.44 106.942 -167.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -164.84 -2.2 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.567 1.321 . . . . 71.03 114.567 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.18 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 119.049 2.981 . . . . 72.44 119.049 -165.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.6 p -89.82 -29.59 18.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 121.506 1.957 . . . . 73.4 113.918 -165.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.3 t -123.72 -43.83 2.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.249 0.833 . . . . 71.23 113.249 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.55 24.47 0.13 Allowed Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.373 -1.237 . . . . 52.32 114.885 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -65.63 8.15 0.19 Allowed 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 120.201 2.0 . . . . 63.34 115.179 -170.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.452 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . 78.1 p -148.26 93.54 2.18 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 120.524 -1.36 . . . . 72.4 112.713 -173.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -132.62 20.83 4.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.532 0.733 . . . . 74.53 112.082 174.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.43 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.404 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 52.53 110.254 -163.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.04 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 52.51 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 70.12 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.14 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.05 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.21 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.05 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.12 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.11 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.32 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 62.34 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.45 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.44 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.34 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.31 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.15 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 71.42 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 72.14 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.12 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.12 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.12 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 55.34 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.438 HD12 HG21 ' A' ' 75' ' ' VAL . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.14 106.618 -177.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.43 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 54.25 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 72.35 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.438 HG21 HD12 ' A' ' 70' ' ' ILE . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 74.24 106.327 -177.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 64.53 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.42 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.54 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 73.54 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.26 50.27 0.86 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.44 110.298 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -48.66 146.68 4.92 Favored Pre-proline 0 N--CA 1.467 0.392 0 C-N-CA 124.61 1.164 . . . . 71.1 112.666 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.21 -32.54 8.26 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.834 1.689 . . . . 63.14 112.935 -167.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -156.4 162.47 27.44 Favored Pre-proline 0 C--O 1.235 0.328 0 C-N-CA 125.295 1.438 . . . . 60.01 109.402 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.46 91.87 0.86 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.141 2.561 . . . . 73.01 110.245 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -106.97 44.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 O-C-N 120.522 -1.361 . . . . 73.4 110.142 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.638 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -69.61 154.05 8.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 106.3 -1.741 . . . . 74.13 106.3 162.785 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -59.38 133.19 55.87 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 107.36 -1.348 . . . . 63.25 107.36 159.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 43.63 58.03 3.71 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 126.859 2.064 . . . . 61.44 113.343 155.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.02 -5.28 16.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.426 2.29 . . . . 74.24 112.979 -175.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 66.4 p-90 -126.98 8.8 6.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.528 1.531 . . . . 73.33 112.682 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 C--O 1.247 0.934 0 N-CA-C 106.425 -1.694 . . . . 73.12 106.425 170.759 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.465 0.289 0 N-CA-C 108.743 -0.836 . . . . 70.32 108.743 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -134.68 21.64 3.6 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.449 1.1 . . . . 70.11 111.928 178.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.25 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.24 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.23 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 75' ' ' VAL . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.24 110.569 -177.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 54.31 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.22 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.51 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.45 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.13 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.41 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 63.23 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.51 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 72.51 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.21 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 71.13 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 74.33 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 33.13 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.14 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.4 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 62.33 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.42 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.53 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 54.21 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.53 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.52 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.43 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 64.15 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 61.53 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 72.43 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' A' ' 47' ' ' ALA . 1.6 tm? -131.75 124.74 30.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.446 ' HG3' ' H ' ' A' ' 36' ' ' ARG . 7.1 ptm -169.11 -87.05 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.958 1.708 . . . . 73.41 113.882 155.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' H ' ' HG3' ' A' ' 35' ' ' MET . 19.7 mmt85 -153.92 -55.58 0.11 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.809 1.644 . . . . 64.54 110.21 -174.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 59.71 -33.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 1 C-N-CA 132.099 4.16 . . . . 63.24 117.653 174.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.368 0.0 OUTLIER 46.22 -70.4 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 126.525 1.93 . . . . 62.14 115.671 -141.085 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.22 -65.27 0.59 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 126.254 1.822 . . . . 74.45 113.346 -164.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.51 -39.39 77.58 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.528 -0.732 . . . . 73.44 111.114 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.03 57.68 2.63 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 107.067 -2.413 . . . . 74.23 107.067 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -78.73 29.8 0.2 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.208 1.803 . . . . 75.43 110.689 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.1 p -163.76 9.71 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.779 1.029 . . . . 75.33 113.779 -160.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -76.9 -6.78 53.83 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.239 -0.913 . . . . 71.42 111.732 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.22 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 64.54 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.554 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 31.13 110.565 165.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.12 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 61.21 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.51 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 62.11 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.34 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 70.54 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 71.4 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.12 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.22 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.22 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.12 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.22 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.11 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 64.12 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 71.13 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 70.43 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.44 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 70.34 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 63.15 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 35.23 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.41 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.32 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 73.21 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.23 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.01 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.03 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.54 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 7' ' ' ARG . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.53 105.978 -178.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.03 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.12 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.24 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.01 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t -90.96 51.63 2.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.34 109.469 176.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 p30 -56.03 159.12 6.07 Favored Pre-proline 0 CA--C 1.537 0.48 0 O-C-N 122.269 -0.27 . . . . 64.2 111.374 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -74.78 -19.8 18.05 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 120.602 0.868 . . . . 54.23 113.114 -155.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.4 11.2 ptpt 54.56 155.77 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.561 0 C-N-CA 128.166 2.587 . . . . 62.23 111.249 -158.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -59.49 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.424 -2.596 0 CA-C-O 126.043 2.435 . . . . 41.51 108.164 161.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.58 99.34 5.97 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 111.539 -2.573 . . . . 71.12 106.441 162.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.0 mt -123.75 138.94 51.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 127.9 2.48 . . . . 73.12 105.092 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -91.78 156.43 17.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.431 -1.259 . . . . 60.44 109.27 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 46.35 50.43 12.33 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 124.851 2.262 . . . . 74.24 109.329 -173.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -71.58 -6.77 43.3 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.297 2.239 . . . . 73.02 113.713 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -134.73 4.29 3.31 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 129.709 3.204 . . . . 74.25 111.378 -175.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.258 1.542 0 C-N-CA 125.571 1.548 . . . . 62.21 109.216 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 119.012 -0.518 . . . . 62.23 109.695 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.07 -22.82 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 129.644 3.178 . . . . 64.23 109.208 171.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 70.05 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.55 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.482 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.23 107.142 -177.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.31 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.403 HH21 ' CE1' ' A' ' 78' ' ' HIS . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.04 109.02 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 71.23 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.34 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.22 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.42 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 51.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.33 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.546 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.12 109.842 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 34' ' ' LEU . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.31 110.323 172.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 62.54 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.546 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.32 111.459 174.745 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 61.53 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.31 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 53.13 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 65.15 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.12 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 71.55 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.31 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.11 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.41 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.23 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.15 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 43.32 108.335 151.359 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.23 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 63.45 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 63.45 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 72.03 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.749 HD13 ' N ' ' A' ' 35' ' ' MET . 2.8 tm? -106.28 177.59 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.51 108.146 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.749 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -49.26 178.68 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.673 1.189 . . . . 55.32 113.804 169.405 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HG2' ' HG3' ' A' ' 35' ' ' MET . 1.2 mmm180 77.18 -12.67 1.03 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 128.57 2.748 . . . . 71.53 112.467 -179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.68 -52.15 7.88 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-N 119.838 1.199 . . . . 60.45 111.851 -170.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 65.11 -48.26 0.35 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.357 2.263 . . . . 73.31 116.557 175.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.0 t -61.7 -59.2 5.53 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 120.964 1.711 . . . . 74.34 107.826 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.5 p -62.95 -22.05 66.51 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.746 0.647 . . . . 72.44 112.746 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.5 18.56 23.19 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 121.58 -0.7 . . . . 62.35 112.242 161.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -59.04 -162.76 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.979 2.112 . . . . 75.42 113.339 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 75.95 50.16 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 130.439 3.496 . . . . 42.14 116.548 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -92.98 13.76 19.72 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.43 115.661 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.21 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 61.51 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.55 109.157 164.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.33 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 63.21 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 71.04 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.33 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.14 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 70.25 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 54.12 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.22 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.12 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 65.44 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 62.34 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.24 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 63.22 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.51 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.24 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 61.31 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.44 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 54.42 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.51 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.54 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 72.53 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 63.33 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 41.34 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.11 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 62.55 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.31 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.53 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.23 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.52 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.54 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 7' ' ' ARG . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 70.11 107.133 169.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 62.31 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -153.82 46.33 0.62 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 61.14 108.996 175.082 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.65 55.83 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.382 -0.372 . . . . 70.11 110.35 179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.25 -14.97 20.45 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.636 1.558 . . . . 73.34 113.904 -168.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt 56.91 165.56 0.07 OUTLIER Pre-proline 0 C--O 1.236 0.357 0 C-N-CA 130.051 3.341 . . . . 72.42 113.313 -171.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.31 98.89 0.47 Allowed 'Trans proline' 0 N--CA 1.448 -1.199 0 N-CA-C 107.272 -1.857 . . . . 71.04 107.272 163.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -116.84 43.25 2.3 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.895 2.078 . . . . 73.15 107.926 -173.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -95.04 156.98 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 105.963 -1.866 . . . . 73.01 105.963 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -5.53 59.07 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.108 0.781 . . . . 73.03 113.108 171.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -141.24 105.13 4.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 128.109 2.564 . . . . 73.32 106.105 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -125.82 3.57 7.4 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.399 1.08 . . . . 71.22 110.496 -168.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -142.77 10.32 1.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.332 3.053 . . . . 74.14 110.485 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.249 1.049 0 C-N-CA 124.323 1.049 . . . . 61.25 108.194 167.442 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 CA--C 1.512 -0.486 0 N-CA-C 109.375 -0.602 . . . . 75.14 109.375 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 72.96 -1.46 3.03 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 130.953 3.701 . . . . 41.14 109.175 -178.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 54.4 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 49' ' ' VAL . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.44 108.554 -176.506 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.14 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.43 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 73.2 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.23 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.12 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.14 111.723 163.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.31 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.33 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 44.34 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 73.22 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.31 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 61.11 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.24 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 34' ' ' LEU . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.45 108.631 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.586 ' HA ' HD12 ' A' ' 22' ' ' LEU . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 53.34 110.46 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.02 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.43 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 29' ' ' ALA . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 71.14 110.339 -172.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.32 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.14 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 74.22 112.325 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 53.24 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 74.12 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.31 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.784 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.31 111.472 -152.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 52.21 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.11 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.31 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.612 HD22 ' H ' ' A' ' 35' ' ' MET . 1.4 tm? -74.21 165.58 24.92 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 55.11 109.239 167.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.612 ' H ' HD22 ' A' ' 34' ' ' LEU . 50.9 mtp -58.58 13.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 129.884 3.274 . . . . 54.41 116.771 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 91.0 mtt-85 -138.44 118.83 13.74 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 120.368 -1.458 . . . . 60.42 107.386 173.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -177.11 118.56 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 C-N-CA 128.415 2.686 . . . . 52.1 107.633 159.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -22.56 66.5 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.936 1.244 . . . . 63.42 112.865 174.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -61.27 -32.4 72.23 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.57 1.148 . . . . 72.33 111.237 -169.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.1 t -130.65 -38.68 1.3 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.311 1.845 . . . . 75.14 109.139 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.98 21.59 55.07 Favored Glycine 0 C--N 1.341 0.835 0 O-C-N 121.408 -0.807 . . . . 75.34 112.223 -171.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.41 ' HG2' ' H ' ' A' ' 42' ' ' GLN . 1.9 pt20 -44.61 105.76 0.06 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 127.181 2.193 . . . . 63.44 107.642 167.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 58.0 p -177.23 156.57 1.25 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.922 2.489 . . . . 43.14 111.271 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 174.34 2.54 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 129.208 3.003 . . . . 75.21 114.385 169.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 60.44 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.01 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.01 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.41 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.492 ' HB ' HG13 ' A' ' 4' ' ' VAL . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.33 105.288 162.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.32 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 54.55 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.42 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 44.31 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.12 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 53.22 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 63.04 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 61.44 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.11 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 64.13 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 71.24 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.11 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.23 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.34 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 62.01 111.768 172.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.44 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.21 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.14 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 71.13 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.33 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 74.02 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.35 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.23 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.608 HE21 ' N ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.15 110.209 -177.779 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.41 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.31 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 53.24 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.412 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 55.54 110.081 170.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.24 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.04 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.01 46.84 1.04 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 40.5 108.976 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -57.44 148.05 56.35 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 112.326 0.491 . . . . 64.03 112.326 -167.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -77.09 -23.11 10.77 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 N-CA-C 114.77 1.027 . . . . 62.32 114.77 -149.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.0 ptpt 54.24 165.51 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 128.911 2.884 . . . . 73.03 115.65 -177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -71.19 104.98 1.62 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 N-CA-C 107.772 -1.664 . . . . 71.14 107.772 157.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -109.39 26.52 10.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.945 1.298 . . . . 71.01 109.481 173.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.58 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.1 mp -76.38 158.08 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 106.273 -1.751 . . . . 73.23 106.273 168.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -84.42 -3.32 58.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.699 0.629 . . . . 53.12 112.699 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -135.25 158.88 43.23 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 125.959 1.704 . . . . 61.44 108.0 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -133.88 11.18 3.97 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.398 1.079 . . . . 44.41 111.552 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -137.52 4.29 2.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.005 2.122 . . . . 74.2 111.441 -176.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.249 1.044 0 C-N-CA 125.735 1.614 . . . . 73.14 109.964 -179.175 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 118.367 -0.825 . . . . 73.32 112.381 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.51 108.068 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.51 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 55.01 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.15 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.611 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.31 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 33.43 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 63.11 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.24 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.23 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.23 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 53.11 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 73.23 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.35 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.34 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.32 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 73.11 110.122 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 60.34 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 71.12 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.864 HD13 ' HB2' ' A' ' 29' ' ' ALA . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 51.22 108.424 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.44 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 52.11 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 60.21 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 71.31 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 33.23 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.22 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.864 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.24 108.347 151.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 61.25 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 63.21 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.15 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' C ' HD13 ' A' ' 34' ' ' LEU . 3.4 tm? . . . . . 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.33 107.172 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 63.11 114.635 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.44 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.13 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.54 110.169 168.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.31 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.34 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.14 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 73.14 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.53 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.35 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.52 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 61.24 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 71.32 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 72.42 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.43 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 62.23 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 61.12 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 51.03 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 64.14 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 54.44 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.42 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 53.44 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 64.45 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.23 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 54.12 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.14 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 65.15 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 53.35 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.31 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.54 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 63.55 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.13 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.12 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.611 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.13 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.44 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.04 114.711 -175.99 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 114.686 1.365 . . . . 73.11 114.686 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 73.21 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.42 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.52 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.4 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.23 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 70.3 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.24 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.31 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.1 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.4 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.41 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 65.1 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.52 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.53 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.43 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.54 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 65.22 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.11 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 70.11 109.054 -177.394 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.4 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 71.42 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.34 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 54.24 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.512 HG11 ' CE2' ' A' ' 51' ' ' PHE . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.4 109.066 -171.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 72.41 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 44.0 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 62.3 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.42 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.33 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 70.04 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tm? . . . . . 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 70.5 110.258 178.809 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.11 114.876 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.34 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.1 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.12 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.21 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 43.01 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.32 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.512 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 72.3 109.59 -178.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.23 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 72.43 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.43 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.419 HE22 ' HD3' ' A' ' 59' ' ' ARG . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.32 112.286 -176.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 70.3 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 62.11 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 63.51 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HE22 ' A' ' 55' ' ' GLN . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 71.12 112.885 -176.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.2 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.2 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.44 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.2 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 63.11 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.14 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.4 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.53 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 53.44 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.52 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.42 106.774 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 71.12 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.44 112.131 -174.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.24 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 52.11 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 64.12 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.33 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.51 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.42 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.31 111.85 175.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.12 109.547 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 118.063 -0.97 . . . . 61.15 111.332 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.42 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' ' 77' ' ' MET . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 63.45 105.923 161.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 73.34 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.41 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.54 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 61.41 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 64.51 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.01 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.04 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 64.4 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.32 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.42 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.14 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.2 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.444 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 73.13 110.779 -172.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.4 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.23 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 29' ' ' ALA . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.21 108.823 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.34 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.43 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.01 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.3 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.33 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 63.32 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.767 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.42 114.06 -174.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 53.45 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.35 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.22 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.32 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.21 106.736 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.377 0.51 . . . . 55.41 112.377 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 54.04 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.23 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.34 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 62.14 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.52 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 72.51 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.24 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 73.51 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 71.25 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.55 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.13 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.12 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 74.44 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.21 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.415 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.22 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.23 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 34.15 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 62.0 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 74.0 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 73.43 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.32 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.22 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 64.3 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 64.2 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.2 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.02 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.44 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 71.2 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.11 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.22 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.413 ' HB2' HG13 ' A' ' 4' ' ' VAL . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 64.41 109.961 171.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.2 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.22 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.297 0 N-CA-C 112.568 0.581 . . . . 70.53 112.568 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.22 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.3 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.3 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.23 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.22 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.23 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 18' ' ' ILE . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 73.33 109.308 163.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.21 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.41 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.34 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.4 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.13 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.44 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.32 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.13 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.418 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.22 109.266 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.32 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.33 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.13 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 29' ' ' ALA . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 72.34 108.332 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.44 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.44 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.451 ' CD2' HD21 ' A' ' 64' ' ' ASN . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.24 112.547 175.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 63.11 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 64.12 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.11 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.463 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 52.32 108.672 157.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.54 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 63.34 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 62.12 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.53 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.2 108.608 165.22 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.453 0 CA-C-O 118.393 -0.813 . . . . 74.43 112.947 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.02 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.52 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.42 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.21 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 54.33 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.54 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 64.53 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 23.44 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.54 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 73.4 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.52 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.52 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 52.4 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 64.54 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 65.52 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.21 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 70.14 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 41.22 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.451 HD21 ' CD2' ' A' ' 25' ' ' HIS . 64.0 m-80 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 71.22 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.31 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.3 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.14 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 71.22 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.32 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.12 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 61.33 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.42 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HE3' ' C ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.32 106.599 170.695 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.407 ' N ' ' HE3' ' A' ' 74' ' ' LYS . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.33 108.244 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.52 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.22 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.24 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.53 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.42 108.814 160.659 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.223 -0.314 0 CA-C-O 122.578 1.18 . . . . 73.33 109.912 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.31 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.21 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.34 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.34 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.14 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.02 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 63.32 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.15 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.23 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.43 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 64.24 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.01 111.845 -176.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.35 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 65.54 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.01 109.286 172.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.426 HD11 HD23 ' A' ' 34' ' ' LEU . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.45 109.191 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.35 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.44 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.35 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.801 HD13 ' HB2' ' A' ' 29' ' ' ALA . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.42 110.923 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.11 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.33 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.23 111.687 163.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.01 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.41 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.44 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.801 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.23 114.317 -170.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.14 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.44 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' HB1' ' A' ' 29' ' ' ALA . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 72.15 111.674 -167.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 72.23 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.426 HD23 HD11 ' A' ' 18' ' ' ILE . 1.7 tm? . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.22 109.986 172.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 70.15 114.928 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.42 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.43 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 50.44 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 70.31 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.44 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.2 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.1 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.54 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.33 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 64.32 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 64.3 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.11 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 52.44 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.21 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.14 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.13 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.44 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 64.23 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.41 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 71.03 113.073 168.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 51.3 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.4 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 51.45 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 70.33 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 65.44 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 65.25 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.43 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 51.33 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.32 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.14 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 65.32 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.05 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.13 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.02 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.2 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.2 107.064 173.198 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 120.48 0.181 . . . . 73.34 110.624 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 64.55 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.45 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 64.43 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.31 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.451 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.42 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.15 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.14 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.12 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 51.43 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.12 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 73.35 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.51 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' HD22 ' A' ' 34' ' ' LEU . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 64.43 109.719 172.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.44 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.34 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 65.14 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 64.42 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 61.23 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 72.31 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 62.42 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 53.41 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.24 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.55 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.02 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.52 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.403 ' NE2' ' H ' ' A' ' 28' ' ' GLN . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 72.34 107.224 167.013 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 65.31 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 74.25 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.42 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 71.45 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.03 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.424 HD22 ' N ' ' A' ' 15' ' ' GLU . 4.7 tt . . . . . 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 63.55 108.766 164.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 118.96 -0.543 . . . . 72.51 110.958 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.33 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 52.12 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 72.41 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.43 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.42 105.693 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.24 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.41 111.813 -164.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.14 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.05 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 63.11 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.31 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.21 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.52 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 63.12 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.54 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 72.43 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.415 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 53.34 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.15 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.04 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.35 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 65.52 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.41 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 72.12 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 70.23 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.42 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 70.45 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.23 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.21 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.11 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 54.21 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 64.22 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.41 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.451 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 62.24 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 73.41 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 62.52 108.767 171.54 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 118.218 -0.896 . . . . 71.12 113.275 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 70.1 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 73.21 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.31 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.34 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 71.33 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.43 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.32 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.34 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.13 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 51.43 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 71.32 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.11 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 63.54 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.23 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.31 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 72.22 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.52 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 64.31 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.4 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 71.31 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.4 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.51 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HG22 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 51.34 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.34 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.32 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.21 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.2 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.15 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.32 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.41 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 73.3 107.986 173.642 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.34 115.296 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 43.33 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.23 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.42 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 65.33 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.43 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.43 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 72.4 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.3 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 73.13 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.41 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 72.52 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.33 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.2 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.32 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 74.54 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.22 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 62.22 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.3 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.02 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.1 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.04 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 m170 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.34 114.908 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 62.22 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 71.34 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.21 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 63.12 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 53.43 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.43 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.04 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.2 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.42 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 52.52 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.2 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.33 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.22 108.148 173.662 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 N--CA 1.468 0.47 0 CA-C-O 119.422 -0.323 . . . . 70.32 111.271 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 63.12 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 62.02 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.54 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 61.44 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 63.54 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 61.34 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 35.34 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.51 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.21 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.41 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 50.22 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.583 ' N ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.45 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.32 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.04 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 64.41 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HA ' HD21 ' A' ' 22' ' ' LEU . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.12 113.122 -169.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 41.25 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.24 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.634 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.21 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 64.44 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.02 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.51 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 62.42 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.754 HG11 ' CE2' ' A' ' 51' ' ' PHE . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.01 109.439 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.04 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.626 ' H ' HG12 ' A' ' 27' ' ' VAL . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 43.41 112.137 -146.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.24 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.01 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 70.01 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.21 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.12 111.624 173.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.426 1.269 . . . . 51.33 114.426 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.22 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.22 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 61.22 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 74.14 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.452 HG11 ' CZ3' ' A' ' 60' ' ' TRP . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.34 107.464 174.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.41 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.754 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 71.41 109.604 -178.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.24 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.44 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.11 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.34 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 24.02 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.42 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.34 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . 0.634 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 61.15 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.35 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.21 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 71.32 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.45 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.11 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 54.23 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 34.52 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 34.33 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.35 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 52.04 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 35.11 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.54 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 74.15 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 72.44 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.33 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 63.55 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.24 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.42 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.14 112.752 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 118.515 -0.755 . . . . 74.13 112.51 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.409 HG12 ' CB ' ' A' ' 50' ' ' GLU . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.32 105.884 -176.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 72.02 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.34 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.41 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.12 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.3 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.541 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.01 111.236 -175.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 12' ' ' ALA . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.43 112.406 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 74.21 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 10' ' ' PRO . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.52 114.188 -170.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 72.51 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 55.42 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.2 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 63.1 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.54 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.494 ' CD1' HD23 ' A' ' 34' ' ' LEU . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 72.13 109.416 172.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 71.53 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.13 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.52 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.11 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.32 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.22 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.34 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 54.41 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 73.1 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.53 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.1 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.3 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.44 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 63.43 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.05 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.494 HD23 ' CD1' ' A' ' 18' ' ' ILE . 1.3 tm? . . . . . 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.3 109.638 174.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 115.026 1.491 . . . . 71.12 115.026 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.12 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.42 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.541 ' HB2' ' CD2' ' A' ' 9' ' ' LEU . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.41 109.247 -176.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 72.03 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 52.53 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CB ' HG12 ' A' ' 3' ' ' ILE 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 71.13 113.14 164.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.23 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.34 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.21 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 65.23 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 62.22 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.34 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.2 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.31 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.32 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.11 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.23 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.22 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.1 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 52.44 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.34 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 70.01 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.54 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.44 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.3 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.3 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.3 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 53.44 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.42 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.1 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 63.4 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.41 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.44 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.42 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.34 108.469 158.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 119.214 -0.422 . . . . 71.54 112.001 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.41 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 72.43 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.45 ' C ' HD22 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.4 109.861 166.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.461 HD21 ' CZ3' ' A' ' 60' ' ' TRP . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.12 108.548 -168.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 60.54 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.24 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.41 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.32 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 72.11 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 71.53 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.21 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.14 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.21 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 55.24 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.524 ' HA ' HD12 ' A' ' 22' ' ' LEU . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.42 110.126 173.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.41 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 63.41 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' ' 29' ' ' ALA . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.53 108.26 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 55.24 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 64.32 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.52 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.24 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.506 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 72.31 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.689 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.32 115.227 -165.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.41 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.4 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.11 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.21 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.42 113.333 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 108.242 -1.022 . . . . 71.12 108.242 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.32 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 54.44 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.42 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.12 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.54 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.32 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.43 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 41.23 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.5 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 52.12 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 73.14 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 64.21 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 73.33 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 61.24 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 55.23 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.15 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.31 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.13 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.21 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.32 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 71.31 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 61.42 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.32 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 72.54 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.44 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.13 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.32 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.55 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.55 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.41 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.15 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.23 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.54 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 72.13 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 71.13 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.22 106.984 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 108.636 -0.875 . . . . 73.44 108.636 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 63.14 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 60.15 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.42 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 71.41 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 73.41 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.35 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 51.04 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.51 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.11 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.22 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.12 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.43 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.55 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 71.55 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 73.33 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 22' ' ' LEU . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.04 107.017 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.33 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.11 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 63.54 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.843 HD13 ' HB2' ' A' ' 29' ' ' ALA . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 71.32 109.068 -177.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 61.55 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 63.45 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.424 ' CE1' HD21 ' A' ' 64' ' ' ASN . 91.5 m-70 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.13 112.971 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 54.23 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 71.52 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.554 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.54 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.843 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.31 109.937 -157.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.41 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 73.23 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 61.32 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.14 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 47' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 54.05 108.261 175.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 64.15 114.351 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.15 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 72.45 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.485 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.13 110.517 -177.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 74.13 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 44.23 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.35 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.614 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.23 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.41 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 62.13 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.33 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.41 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.34 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.43 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 61.54 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.23 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.54 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.23 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 64.33 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 35.4 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.424 HD21 ' CE1' ' A' ' 25' ' ' HIS . 70.2 m-80 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.33 111.355 -176.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 72.12 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 73.11 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.53 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.22 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.45 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.432 HD12 HG21 ' A' ' 75' ' ' VAL . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 74.22 106.392 -166.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 73.34 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.22 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.21 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.432 HG21 HD12 ' A' ' 70' ' ' ILE . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 62.21 106.688 168.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.55 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 73.43 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.44 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.53 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 72.15 106.127 163.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.446 -0.625 0 N-CA-C 108.135 -1.061 . . . . 74.33 108.135 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 53.34 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 61.45 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 63.23 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 61.14 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.42 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.42 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.03 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 55.44 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 41.31 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.31 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.11 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.41 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.14 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 62.31 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.22 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 64.15 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 72.15 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 62.15 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.565 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 64.02 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.15 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 72.02 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 55.51 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.03 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.02 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.04 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.42 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 62.35 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.13 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.12 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.35 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.12 106.352 166.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 . . . . . 0 CA--C 1.532 0.264 0 N-CA-C 112.118 0.414 . . . . 74.21 112.118 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.21 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.15 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.24 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.21 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 61.12 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.32 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.21 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.24 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 54.51 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 60.11 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.43 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.45 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 53.35 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.05 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.42 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . 0.565 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.33 111.454 176.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.43 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.25 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 60.25 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.45 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 62.44 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.43 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 63.03 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 72.33 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.05 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 71.45 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 73.03 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 71.42 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 62.32 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 63.41 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 72.12 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 53.55 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.41 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 53.41 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.15 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 54.45 108.024 172.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 111.461 0.171 . . . . 73.32 111.461 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 73.21 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 52.34 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.44 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 61.3 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.41 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.23 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.42 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.14 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.24 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.03 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.35 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.01 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.44 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.42 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 22' ' ' LEU . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.32 110.744 176.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 73.21 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.3 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 29' ' ' ALA . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 64.1 109.813 172.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 63.43 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.52 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.559 ' CE1' HD21 ' A' ' 64' ' ' ASN . 38.4 m-70 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.14 111.423 176.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.13 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.03 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.23 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.508 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.42 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.35 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 60.41 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 72.45 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 63.34 109.341 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 119.218 -0.42 . . . . 75.21 111.988 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.11 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.15 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 53.41 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.11 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 51.12 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.35 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 61.31 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 63.35 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.33 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.41 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.45 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.23 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.13 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.24 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.24 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.01 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.23 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.01 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.559 HD21 ' CE1' ' A' ' 25' ' ' HIS . 65.8 m-80 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.44 110.778 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.24 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 23.7 m170 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 63.3 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.1 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 63.13 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 61.4 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.2 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 60.2 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.3 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.12 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 64.41 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 53.21 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.34 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 71.01 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 71.25 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.23 106.521 162.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.41 107.689 -172.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 62.24 111.412 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 64.41 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 ' HB ' ' A' ' 49' ' ' VAL 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.1 115.764 172.695 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 50.14 108.58 167.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.615 HD11 ' HH2' ' A' ' 60' ' ' TRP . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 71.34 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.21 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 62.12 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.35 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.44 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 70.15 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.5 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 45.55 112.57 -170.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 71.13 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.43 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.02 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 45.55 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 64.24 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HA ' HD12 ' A' ' 22' ' ' LEU . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 50.33 111.055 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.43 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.13 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.746 HD13 ' CB ' ' A' ' 29' ' ' ALA . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 71.23 109.809 -178.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 62.45 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.22 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 54.51 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.14 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 44.44 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.23 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.746 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 50.41 112.892 -164.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 73.3 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 70.33 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.41 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.03 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 72.22 110.813 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 119.391 -0.338 . . . . 71.34 111.622 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 62.45 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 52.32 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 54.4 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.43 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.682 ' HB ' HG13 ' A' ' 4' ' ' VAL . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 54.11 106.981 168.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.23 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 61.2 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 62.13 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.43 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.22 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.03 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.1 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 63.32 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.1 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . 0.615 ' HH2' HD11 ' A' ' 6' ' ' LEU . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 70.41 113.543 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.1 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.43 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.02 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 52.14 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 65.44 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.4 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 63.24 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.05 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.03 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.488 HG22 ' HG ' ' A' ' 71' ' ' LEU . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 63.34 108.541 -177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.488 ' HG ' HG22 ' A' ' 70' ' ' ILE . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 71.24 111.689 -175.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.31 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.15 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 72.01 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 54.12 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.24 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.467 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 54.4 110.078 165.681 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 60.3 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 73.42 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 1.9 t . . . . . 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.43 108.125 178.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 118.979 -0.534 . . . . 73.42 111.649 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.34 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.32 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.44 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 65.44 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.12 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.24 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.43 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.404 ' HG3' HE21 ' A' ' 73' ' ' GLN . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.4 108.453 167.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.22 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 44.31 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 62.11 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 43.43 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 73.34 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.41 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.12 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 22' ' ' LEU . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 61.53 107.56 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 61.3 110.313 -174.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 74.34 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 71.3 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.836 HD13 ' CB ' ' A' ' 29' ' ' ALA . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 71.32 108.108 172.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.33 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.21 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CD2' HG23 ' A' ' 27' ' ' VAL . 7.0 t60 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 54.3 107.361 -173.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.23 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.48 HG23 ' CD2' ' A' ' 25' ' ' HIS . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 54.21 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.836 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.12 113.776 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 74.4 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.13 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.412 HG11 HD12 ' A' ' 18' ' ' ILE . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.43 108.25 173.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.13 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.12 110.408 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 118.645 -0.693 . . . . 74.2 111.481 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.34 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 70.53 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 44.24 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.21 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 45.5 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 72.25 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 70.12 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.55 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.02 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.406 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.35 113.542 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.34 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.12 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.13 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 65.23 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 73.41 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.21 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.22 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.54 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 51.44 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.24 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.3 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 72.1 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.14 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 62.24 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 64.21 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 71.54 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 60.12 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.44 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.404 HE21 ' HG3' ' A' ' 10' ' ' PRO . 3.8 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.13 108.253 -178.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 72.43 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.4 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 70.53 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 64.24 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.13 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 70.54 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.14 105.516 153.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 110.003 -0.369 . . . . 62.01 110.003 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.33 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.12 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 72.21 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 72.13 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.24 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.12 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 60.24 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.14 110.749 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.12 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 51.31 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.426 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.31 111.669 -167.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.43 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.42 110.348 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 43.54 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.22 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.11 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.12 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 14.2 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 73.12 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.541 ' CD1' ' HB2' ' A' ' 29' ' ' ALA . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 65.41 109.365 168.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.33 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.11 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.22 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 53.34 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 61.15 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.15 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.541 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 64.11 109.168 152.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.42 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.3 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 51.54 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.14 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.404 ' HG ' ' HB2' ' A' ' 47' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.03 106.983 169.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 112.082 0.401 . . . . 74.53 112.082 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.43 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.404 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 52.53 110.254 -163.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.04 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 52.51 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 70.12 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.14 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.05 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.21 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.05 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.12 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.11 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.32 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 62.34 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.45 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.44 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.34 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.31 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.15 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 71.42 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 72.14 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.12 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.12 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.12 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 55.34 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.438 HD12 HG21 ' A' ' 75' ' ' VAL . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.14 106.618 -177.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.43 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 54.25 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 72.35 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.438 HG21 HD12 ' A' ' 70' ' ' ILE . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 74.24 106.327 -177.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 64.53 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.42 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.54 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 73.54 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.44 110.298 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 N--CA 1.466 0.367 0 CA-C-O 118.925 -0.559 . . . . 70.11 111.928 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.25 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.24 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.23 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 75' ' ' VAL . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.24 110.569 -177.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 54.31 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.22 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.51 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.45 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.13 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.41 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 63.23 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.51 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 72.51 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.21 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 71.13 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 74.33 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 33.13 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.14 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.4 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 62.33 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.42 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.53 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 54.21 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.53 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.52 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.43 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 64.15 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 61.53 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 72.43 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' A' ' 47' ' ' ALA . 1.6 tm? . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 118.261 -0.876 . . . . 71.42 111.732 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.22 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 64.54 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.554 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 31.13 110.565 165.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.12 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 61.21 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.51 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 62.11 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.34 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 70.54 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 71.4 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.12 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.22 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.22 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.12 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.22 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.11 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 64.12 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 71.13 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 70.43 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.44 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 70.34 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 63.15 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 35.23 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.41 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.32 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 73.21 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.23 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.01 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.03 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.54 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 7' ' ' ARG . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.53 105.978 -178.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.03 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.12 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.24 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.01 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.34 109.469 176.275 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.913 -1.041 . . . . 64.23 109.208 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 70.05 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.55 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.482 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.23 107.142 -177.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.31 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.403 HH21 ' CE1' ' A' ' 78' ' ' HIS . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.04 109.02 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 71.23 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.34 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.22 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.42 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 51.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.33 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.546 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.12 109.842 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 34' ' ' LEU . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.31 110.323 172.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 62.54 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.546 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.32 111.459 174.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 61.53 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.31 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 53.13 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 65.15 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.12 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 71.55 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.31 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.11 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.41 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.23 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.15 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 43.32 108.335 151.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.23 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 63.45 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 63.45 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 72.03 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.66 HD23 ' HB2' ' A' ' 47' ' ' ALA . 2.8 tm? . . . . . 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.51 108.146 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 . . . . . 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.43 115.661 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.21 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 61.51 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.55 109.157 164.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.33 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 63.21 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 71.04 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.33 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.14 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 70.25 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 54.12 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.22 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.12 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 65.44 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 62.34 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.24 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 63.22 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.51 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.24 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 61.31 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.44 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 54.42 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.51 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.54 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 72.53 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 63.33 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 41.34 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.11 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 62.55 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.31 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.53 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.23 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.52 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.54 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 7' ' ' ARG . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 70.11 107.133 169.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 62.31 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 61.14 108.996 175.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.191 0 N-CA-C 109.175 -0.676 . . . . 41.14 109.175 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 54.4 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 49' ' ' VAL . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.44 108.554 -176.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.14 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.43 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 73.2 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.23 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.12 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.632 ' HB3' HE21 ' A' ' 73' ' ' GLN . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.14 111.723 163.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.31 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.33 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 44.34 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 73.22 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.31 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 61.11 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.24 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 34' ' ' LEU . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.45 108.631 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.586 ' HA ' HD12 ' A' ' 22' ' ' LEU . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 53.34 110.46 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.02 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.43 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 29' ' ' ALA . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 71.14 110.339 -172.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.32 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.14 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.459 ' CE1' HD21 ' A' ' 64' ' ' ASN . 76.7 m-70 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 74.22 112.325 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 53.24 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 74.12 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.31 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.784 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.31 111.472 -152.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 52.21 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.11 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.31 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 18' ' ' ILE . 1.4 tm? . . . . . 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 55.11 109.239 167.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 114.385 1.254 . . . . 75.21 114.385 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 60.44 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.01 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.01 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.41 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.492 ' HB ' HG13 ' A' ' 4' ' ' VAL . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.33 105.288 162.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.32 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 54.55 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.42 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 44.31 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.12 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 53.22 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 63.04 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 61.44 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.11 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 64.13 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 71.24 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.11 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.23 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.34 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.459 HD21 ' CE1' ' A' ' 25' ' ' HIS . 62.7 m-80 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 62.01 111.768 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.44 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.21 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.14 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 71.13 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.33 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 74.02 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.35 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.23 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.632 HE21 ' HB3' ' A' ' 10' ' ' PRO . 2.2 pm0 -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.15 110.209 -177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.41 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.31 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 53.24 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.412 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 55.54 110.081 170.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.24 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.04 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 40.5 108.976 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.018 -0.992 . . . . 73.32 110.543 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -116.13 -3.75 12.02 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.277 1.399 . . . . 73.32 112.381 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.5 HD11 ' HA ' ' A' ' 83' ' ' LYS . 2.1 mp -97.31 141.63 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 108.068 -1.086 . . . . 74.51 108.068 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.53 98.65 3.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 126.01 1.724 . . . . 73.51 106.885 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.6 ttt -72.52 119.3 16.53 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.678 -1.601 . . . . 55.01 106.678 168.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.78 91.5 4.2 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.333 -1.729 . . . . 75.15 106.333 -179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.611 HH21 ' CE1' ' A' ' 78' ' ' HIS . 34.7 mtm180 -79.91 156.08 27.45 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.099 -0.704 . . . . 73.31 109.099 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.5 mtm 73.35 25.33 2.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.529 1.532 . . . . 33.43 112.865 173.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -67.02 157.17 85.68 Favored Pre-proline 0 CA--C 1.538 0.493 0 O-C-N 120.777 -1.202 . . . . 63.11 109.833 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.69 172.37 15.92 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 122.974 2.449 . . . . 42.24 110.166 168.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tp60 -71.53 -35.8 70.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.317 -0.856 . . . . 75.25 110.186 171.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.35 -21.13 58.58 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.826 1.417 . . . . 61.23 114.826 -170.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.21 157.84 12.59 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.288 0.949 . . . . 62.23 110.853 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.8 p -124.21 164.84 18.68 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.432 -0.581 . . . . 53.11 109.432 -176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -55.38 -34.13 64.07 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.905 -0.588 . . . . 73.23 109.885 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -80.19 -27.51 38.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.763 0.653 . . . . 63.35 112.763 -170.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -47.14 86.97 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 123.036 1.398 . . . . 74.34 108.7 173.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.2 mt -64.08 -45.01 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 114.035 -1.439 . . . . 73.32 108.855 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.2 mtp180 -52.36 -41.5 63.11 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.103 0.865 . . . . 73.11 110.122 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.55 -50.23 66.92 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.73 -0.483 . . . . 60.34 111.985 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.33 -39.55 92.56 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.981 0.912 . . . . 71.12 111.756 -174.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.864 HD13 ' HB2' ' A' ' 29' ' ' ALA . 10.6 mt -63.42 -51.45 65.72 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.424 -0.954 . . . . 51.22 108.424 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.99 -24.98 66.88 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.319 -1.324 . . . . 73.44 112.044 -178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.3 t -66.83 -37.14 83.91 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.799 1.636 . . . . 52.11 110.878 175.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -76.88 -8.52 57.5 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.045 -1.034 . . . . 60.21 112.744 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.58 48.65 28.21 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 108.686 -1.766 . . . . 71.31 108.686 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.43 126.54 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 105.204 -2.147 . . . . 33.23 105.204 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.7 pt20 -69.73 137.7 52.23 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 106.487 -1.672 . . . . 74.22 106.487 167.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.864 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -79.08 134.22 36.76 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 108.347 -0.982 . . . . 75.24 108.347 151.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -75.43 -42.14 54.19 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -151.75 155.52 38.43 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 121.878 -0.514 . . . . 61.25 109.862 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.16 130.04 47.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 107.63 -1.248 . . . . 63.21 107.63 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.9 mtm180 -125.96 86.16 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 127.661 2.384 . . . . 64.15 105.116 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.414 ' C ' HD13 ' A' ' 34' ' ' LEU . 3.4 tm? -145.32 115.3 7.4 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.666 1.586 . . . . 75.33 107.172 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.35 1.1 ptp 43.87 -154.51 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.057 1.743 . . . . 54.23 112.738 -171.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 75.71 -48.44 0.6 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.161 2.984 . . . . 73.13 113.841 165.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -50.71 -39.06 50.58 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.368 1.867 . . . . 74.54 111.958 -175.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 47.05 -66.5 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.753 2.421 . . . . 73.33 114.106 -144.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.0 t -49.04 -66.65 0.36 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.412 1.885 . . . . 34.43 111.72 -161.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 t -66.51 -33.55 75.93 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.268 0.355 . . . . 71.21 110.753 -170.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.83 21.41 2.64 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-O 117.811 -1.55 . . . . 73.24 113.719 161.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.47 4.0 0.61 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.49 1.663 . . . . 75.11 115.49 -165.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.21 72.13 0.78 Allowed 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 126.617 1.967 . . . . 41.45 108.431 -168.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -133.4 -6.16 2.95 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 117.058 -1.449 . . . . 63.11 114.635 -173.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.61 29.0 11.4 Favored Glycine 0 CA--C 1.526 0.78 0 CA-C-N 120.056 1.298 . . . . 73.44 111.121 -164.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -149.58 169.49 20.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.67 1.235 . . . . 65.13 110.603 165.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -125.72 169.26 12.73 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.905 1.682 . . . . 62.54 110.169 168.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -132.11 40.56 3.32 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.252 1.821 . . . . 72.31 111.501 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.96 139.97 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.99 2.116 . . . . 72.34 110.414 -169.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -130.21 140.34 50.74 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.552 0.692 . . . . 74.14 110.668 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -106.48 156.19 18.81 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.39 1.076 . . . . 73.14 110.114 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -27.29 64.62 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.923 0.889 . . . . 75.53 110.582 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -126.45 138.72 53.56 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.551 -1.277 . . . . 71.35 107.551 -169.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.1 -40.36 97.42 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.539 -0.541 . . . . 73.52 109.539 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -58.43 -31.28 67.59 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.992 0.738 . . . . 61.24 112.992 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.09 -29.82 64.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.971 0.805 . . . . 71.32 110.887 -171.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.15 -53.67 45.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.269 -1.382 . . . . 72.42 107.269 175.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.3 m -57.01 -36.5 70.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.71 0.804 . . . . 74.43 110.769 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.73 -58.2 9.12 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 107.957 -1.127 . . . . 62.23 107.957 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -66.14 -36.3 82.76 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.998 -0.546 . . . . 61.12 110.166 -173.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.4 mmm -58.57 -65.4 0.66 Allowed 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.696 1.198 . . . . 51.03 110.494 175.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.84 -31.42 71.24 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 122.88 0.472 . . . . 64.14 111.147 -169.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.5 -4.14 21.35 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.403 0.52 . . . . 54.44 112.403 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -126.43 7.71 7.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.264 1.426 . . . . 75.42 110.85 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 59.07 32.49 22.23 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.963 1.305 . . . . 53.44 108.915 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.0 m170 68.03 19.57 9.28 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.81 1.244 . . . . 64.45 113.541 177.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.54 128.8 19.89 Favored 'General case' 0 C--N 1.346 0.419 0 CA-C-N 119.846 1.203 . . . . 71.23 111.711 166.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.6 mt -100.56 176.07 5.46 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.763 0.825 . . . . 54.12 110.145 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -143.69 110.25 5.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.789 0.836 . . . . 64.14 110.165 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.42 125.16 63.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.506 1.122 . . . . 65.15 108.036 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.5 mt 47.35 37.42 5.95 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.45 1.5 . . . . 73.25 110.051 -169.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 82.03 -17.25 17.9 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-O 117.97 -1.461 . . . . 53.35 114.954 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.95 137.95 45.82 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 121.183 2.492 . . . . 65.31 108.283 -178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -77.71 113.56 15.69 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.826 1.65 . . . . 71.54 107.231 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 66.6 t -106.97 141.52 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 107.208 -1.404 . . . . 63.55 107.208 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.6 m -105.58 157.13 17.61 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.685 1.194 . . . . 73.13 109.158 174.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.28 133.72 45.69 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 123.107 0.563 . . . . 72.12 110.884 -177.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.611 ' CE1' HH21 ' A' ' 7' ' ' ARG . 70.9 m-70 -145.09 135.14 23.84 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 125.791 1.636 . . . . 71.13 109.031 -166.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -76.64 102.63 6.23 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.158 -0.925 . . . . 74.44 109.72 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.8 t -75.73 -6.68 51.76 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.076 1.762 . . . . 54.04 114.711 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -171.51 166.38 4.14 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 124.98 1.312 . . . . 55.33 108.804 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -68.9 -56.15 0.18 Allowed 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 121.245 1.297 . . . . 51.43 111.615 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HA ' HD11 ' A' ' 3' ' ' ILE . 16.1 ptmt -160.1 158.11 25.9 Favored Pre-proline 0 C--O 1.238 0.454 0 C-N-CA 127.234 2.214 . . . . 54.44 109.258 174.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.14 106.41 1.54 Allowed 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 124.516 3.478 . . . . 75.13 108.905 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -109.19 19.46 19.43 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 124.5 1.12 . . . . 74.24 112.435 -175.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.537 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.8 mp -62.01 153.53 5.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 107.067 -1.457 . . . . 73.42 107.067 169.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -5.32 57.93 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.702 -0.624 . . . . 64.31 112.329 176.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -120.99 159.57 25.33 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 129.13 2.972 . . . . 73.24 108.726 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -144.56 11.61 1.47 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.38 1.472 . . . . 74.21 111.129 -175.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -135.37 8.25 3.38 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.807 2.443 . . . . 72.11 111.827 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 C--O 1.248 0.976 0 CA-C-O 116.465 -1.731 . . . . 64.22 107.103 174.417 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.404 ' HB2' ' CD1' ' A' ' 79' ' ' TYR . 4.2 m . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 117.79 -1.1 . . . . 72.22 110.19 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -143.0 13.36 1.86 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.775 1.625 . . . . 73.11 114.686 -174.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 64.4 mt -118.73 133.23 66.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 107.341 -1.355 . . . . 73.21 107.341 168.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -118.18 72.21 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 106.947 -1.501 . . . . 74.42 106.947 -176.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -62.29 119.43 9.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 124.768 1.227 . . . . 73.52 108.065 -176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.0 mt -93.31 146.28 23.84 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.488 -0.93 . . . . 72.4 108.488 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.23 176.79 5.16 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.411 1.484 . . . . 71.23 110.079 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.6 mtm 62.94 18.39 10.81 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.417 1.266 . . . . 70.3 114.417 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.63 148.03 94.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 O-C-N 120.563 -1.335 . . . . 62.24 113.85 -172.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.43 172.8 15.57 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 123.197 2.598 . . . . 73.31 110.932 162.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -101.66 -10.96 19.56 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.231 1.012 . . . . 74.1 111.287 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.75 -10.28 55.82 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.078 -1.013 . . . . 72.4 112.14 171.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 153.63 40.76 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 119.93 1.241 . . . . 74.41 109.183 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 p -129.59 172.57 11.44 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.616 1.167 . . . . 74.5 109.144 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -55.0 -35.76 64.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.248 0.547 . . . . 65.1 110.051 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.95 -18.18 62.02 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.158 -0.928 . . . . 73.52 112.613 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -61.59 -55.71 27.75 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 108.885 -0.783 . . . . 64.53 108.885 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 97.7 mt -58.43 -42.67 84.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 108.609 -0.886 . . . . 73.43 108.609 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp-105 -55.33 -43.26 74.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.472 1.033 . . . . 73.54 111.317 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.67 -39.27 60.57 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-O 119.144 -0.809 . . . . 65.22 112.127 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -58.65 -45.6 88.96 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 118.914 1.357 . . . . 73.11 109.714 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -65.21 -38.44 90.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.054 -0.721 . . . . 70.11 109.054 -177.394 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -67.33 -16.66 64.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 117.985 -1.007 . . . . 74.4 113.448 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.1 t -64.7 -32.81 74.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.581 1.537 . . . . 71.42 110.163 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m-70 -92.6 -12.58 31.33 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.199 0.999 . . . . 53.34 111.665 173.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 92.9 4.24 65.28 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 125.761 1.648 . . . . 54.24 114.209 -178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.512 HG11 ' CE2' ' A' ' 51' ' ' PHE . 1.6 t -74.91 163.62 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 119.442 1.621 . . . . 73.4 109.066 -171.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -80.89 -47.77 13.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.833 1.653 . . . . 72.41 112.631 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 50.5 173.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.019 1.328 . . . . 44.0 112.011 -142.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -126.47 -37.14 2.21 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.018 -1.051 . . . . 62.3 111.593 162.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -135.13 150.74 50.24 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 106.695 -1.594 . . . . 74.42 106.695 -177.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 14.7 t -144.39 84.89 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 107.391 -1.337 . . . . 74.33 107.391 -173.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -84.14 77.67 9.91 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 120.497 -1.377 . . . . 70.04 108.987 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD22 ' H ' ' A' ' 35' ' ' MET . 1.8 tm? -87.71 164.0 16.23 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.935 0.894 . . . . 70.5 110.258 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 43' ' ' SER . 45.0 mtp -54.32 87.54 0.0 OUTLIER 'General case' 0 C--O 1.236 0.374 0 C-N-CA 127.816 2.446 . . . . 64.41 111.966 168.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.53 -74.28 0.34 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.256 2.223 . . . . 71.33 108.081 169.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' ND2' ' HB2' ' A' ' 40' ' ' SER . 63.3 t-20 -64.24 94.37 0.11 Allowed 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.7 1.6 . . . . 73.1 113.01 -169.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -33.54 76.09 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 118.335 -0.841 . . . . 63.11 112.943 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -43.67 71.3 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.491 0.587 . . . . 62.11 110.79 -173.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.441 ' HB2' ' ND2' ' A' ' 37' ' ' ASN . 5.4 t -63.1 -58.73 6.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.062 -1.088 . . . . 64.03 108.062 168.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 108.44 38.55 1.92 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.939 -1.264 . . . . 73.42 109.939 -169.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -72.73 5.03 3.42 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.813 0.806 . . . . 72.34 111.503 169.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.487 ' HA ' ' HG2' ' A' ' 35' ' ' MET . 11.3 p -131.01 102.78 6.18 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.348 1.459 . . . . 72.22 109.701 -158.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -153.53 0.21 0.24 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 114.876 1.435 . . . . 74.11 114.876 -172.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.12 29.34 20.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 120.405 1.457 . . . . 63.34 111.325 -165.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -160.36 175.51 12.74 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.24 1.816 . . . . 74.1 108.94 168.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -144.89 172.71 12.65 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.668 1.587 . . . . 71.12 110.102 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -136.44 94.09 2.97 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.686 1.194 . . . . 74.21 109.062 170.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.53 138.36 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.704 -1.221 . . . . 43.01 107.704 162.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -109.77 146.36 35.09 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 126.136 1.774 . . . . 73.32 108.85 168.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.512 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.7 m-85 -118.46 162.27 18.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 126.461 1.905 . . . . 72.3 109.59 -178.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.2 m -103.75 -9.02 19.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.737 1.615 . . . . 71.23 112.79 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -134.44 129.67 35.63 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 106.541 -1.652 . . . . 72.43 106.541 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.57 -49.05 71.29 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 108.862 -0.792 . . . . 73.43 108.862 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.419 HE22 ' HD3' ' A' ' 59' ' ' ARG . 2.4 pp0? -61.98 -32.14 72.56 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.387 0.675 . . . . 73.32 112.286 -176.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.99 -34.5 78.23 Favored 'General case' 0 C--N 1.342 0.275 0 N-CA-C 108.543 -0.91 . . . . 70.3 108.543 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.96 -45.75 87.76 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 107.948 -1.13 . . . . 62.11 107.948 -178.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -47.27 81.34 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 125.44 1.496 . . . . 63.51 110.044 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HE22 ' A' ' 55' ' ' GLN . 14.0 ttt85 -72.41 -5.95 40.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.835 1.254 . . . . 71.12 112.885 -176.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -99.83 -48.6 4.64 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.135 0.974 . . . . 74.2 109.902 166.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.3 mmm -52.57 -70.45 0.09 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.858 1.663 . . . . 70.2 111.308 178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.17 -31.44 71.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.762 0.825 . . . . 72.44 109.983 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.76 -7.79 47.56 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.523 1.129 . . . . 63.2 113.165 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -117.3 4.43 12.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 127.201 2.201 . . . . 63.11 110.316 172.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 61.02 21.45 11.8 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 120.805 -1.184 . . . . 72.14 111.284 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.1 m170 71.58 16.42 5.85 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.978 2.511 . . . . 65.4 114.368 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.3 p -138.63 150.29 46.1 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 120.007 1.276 . . . . 74.53 110.054 173.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.3 mt -130.99 174.22 10.22 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.628 1.571 . . . . 53.44 109.04 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -142.13 106.78 4.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.253 -0.43 . . . . 74.52 110.739 174.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mt -115.89 114.31 45.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 125.824 1.65 . . . . 73.42 106.774 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mp 64.95 -15.55 0.09 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 130.248 3.419 . . . . 71.12 112.329 -171.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 135.48 -13.13 4.29 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 126.128 1.823 . . . . 63.44 112.131 -174.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -74.67 129.45 37.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 107.346 -1.353 . . . . 73.24 107.346 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -66.15 127.67 33.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.525 -1.287 . . . . 52.11 107.525 168.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 25.5 t -123.35 152.07 28.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 126.505 1.922 . . . . 64.12 107.979 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.5 p -121.98 158.45 29.07 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.017 1.327 . . . . 65.33 108.759 172.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -131.04 152.16 50.64 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.53 0.604 . . . . 73.51 112.253 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -145.59 149.2 34.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.38 1.472 . . . . 74.42 111.826 -171.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' A' ' 1' ' ' SER . 14.8 m-85 -81.49 82.4 7.3 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.139 0.976 . . . . 74.31 111.85 175.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.03 61.56 2.97 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.207 1.003 . . . . 73.12 109.547 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -51.48 155.38 2.64 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 125.768 1.627 . . . . 73.1 113.899 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.02 -45.56 7.69 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 121.868 1.712 . . . . 73.41 111.578 -174.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 84' ' ' PRO . 8.3 ptmt 58.1 164.95 0.08 OUTLIER Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 131.312 3.845 . . . . 71.04 113.397 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 56.7 Cg_endo -66.99 106.21 1.11 Allowed 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.237 1.958 . . . . 43.33 109.153 165.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -117.49 26.35 9.79 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.28 1.432 . . . . 32.02 111.863 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.627 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.6 mp -67.18 158.84 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 O-C-N 120.244 -1.535 . . . . 74.2 107.843 -177.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.21 137.04 35.89 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.606 -1.257 . . . . 72.01 107.606 169.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.8 71.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 123.851 1.786 . . . . 74.04 110.167 -168.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -74.48 -15.08 60.9 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 113.39 -1.732 . . . . 72.24 112.742 -167.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -130.16 4.28 4.81 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.827 1.651 . . . . 71.12 113.031 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 91' ' ' LEU . 3.2 mm? . . . . . 0 C--O 1.244 0.804 0 N-CA-C 103.877 -2.638 . . . . 70.21 103.877 168.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.251 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 116.994 -1.479 . . . . 64.33 114.772 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 76.34 -2.51 2.71 Favored 'General case' 0 C--N 1.349 0.565 0 C-N-CA 127.74 2.416 . . . . 61.15 111.332 -166.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.2 mt -137.38 135.31 46.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 120.362 1.437 . . . . 74.42 108.223 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' ' 77' ' ' MET . 69.3 t -111.61 113.75 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 105.923 -1.881 . . . . 63.45 105.923 161.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 34.6 ttp -88.06 120.51 29.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.591 -1.633 . . . . 73.34 106.591 166.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 47.9 mt -91.41 124.43 35.59 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 106.991 -1.485 . . . . 75.41 106.991 173.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -108.91 154.03 22.72 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 124.524 1.13 . . . . 75.54 109.047 175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.0 mtm 67.48 62.56 0.44 Allowed 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.238 1.415 . . . . 61.41 109.964 -176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.74 142.45 25.22 Favored Pre-proline 0 C--O 1.24 0.603 0 CA-C-O 118.939 -0.553 . . . . 64.51 110.136 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.5 155.97 28.33 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.128 2.552 . . . . 73.01 110.582 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -68.67 -23.57 64.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.499 -1.228 . . . . 74.0 111.528 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.92 24.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 117.65 -1.167 . . . . 62.04 112.972 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.98 154.28 31.07 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.959 1.254 . . . . 60.0 110.921 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.2 p -121.36 161.22 22.47 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 124.686 1.194 . . . . 64.4 110.145 -172.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -45.54 -39.44 7.46 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.584 0.707 . . . . 73.32 111.431 171.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -67.41 -35.72 79.85 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.623 2.369 . . . . 63.42 112.315 -173.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.92 -28.23 69.69 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.59 1.556 . . . . 73.14 111.291 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.4 mt -82.6 -46.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 124.304 1.042 . . . . 75.2 108.626 173.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.444 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 mtp-105 -55.35 -42.78 74.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 119.187 -0.435 . . . . 73.13 110.779 -172.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.93 -35.87 61.32 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.368 -0.684 . . . . 74.4 113.048 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -42.11 99.72 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.008 1.404 . . . . 72.23 108.988 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 29' ' ' ALA . 4.5 mt -59.79 -44.19 94.07 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.823 -0.806 . . . . 75.21 108.823 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.03 -24.38 61.54 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 114.225 1.194 . . . . 72.34 114.225 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.04 -40.92 64.29 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.989 1.268 . . . . 73.43 109.8 167.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -89.04 -9.37 51.52 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.374 -0.829 . . . . 63.01 112.39 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.32 -2.39 65.37 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.265 1.888 . . . . 51.3 113.707 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.9 t -70.22 139.98 19.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 CA-C-N 119.547 1.674 . . . . 63.33 110.868 -166.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.18 -31.92 71.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.874 1.269 . . . . 63.32 114.37 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.767 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 43.55 86.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.396 2.278 . . . . 75.42 114.06 -174.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.41 -41.49 89.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.817 0.303 . . . . 53.45 111.817 -170.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.77 157.83 44.11 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.288 -1.375 . . . . 63.35 107.288 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.33 157.7 17.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 107.933 -1.136 . . . . 74.22 107.933 176.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -137.97 93.52 2.78 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.228 -1.767 . . . . 74.32 106.228 170.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -140.53 -152.82 0.43 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.758 1.623 . . . . 73.21 106.736 176.653 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.43 ' H ' HD13 ' A' ' 34' ' ' LEU . 5.8 ttp 69.49 -153.39 0.14 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.85 1.66 . . . . 53.4 109.347 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.6 149.92 42.96 Favored 'General case' 0 CA--C 1.497 -1.087 0 C-N-CA 125.726 1.61 . . . . 71.11 107.997 -177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -153.24 -50.68 0.1 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.925 0.869 . . . . 74.44 112.48 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.08 -24.16 0.07 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 116.899 2.185 . . . . 41.12 116.899 -174.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.2 m -76.53 -74.96 0.21 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.203 1.365 . . . . 52.31 108.021 162.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -70.79 -26.45 63.33 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.289 0.949 . . . . 73.12 113.519 -169.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.34 16.29 27.71 Favored Glycine 0 C--N 1.339 0.748 0 O-C-N 120.888 -1.133 . . . . 71.54 113.095 161.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -62.98 4.33 0.18 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.386 2.675 . . . . 73.22 115.991 -173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 99.7 p -141.47 106.08 4.88 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.463 -1.31 . . . . 75.54 107.463 -156.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -142.72 14.98 1.95 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.71 0.804 . . . . 55.41 112.377 -172.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.12 8.41 85.58 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 124.427 1.013 . . . . 54.04 112.791 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.11 165.81 27.99 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.366 2.266 . . . . 63.23 107.445 169.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -130.34 171.91 12.42 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 127.144 2.178 . . . . 74.34 109.837 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -122.99 154.41 38.47 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.541 1.136 . . . . 63.32 108.283 161.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.9 t -136.44 129.52 46.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 104.551 -2.388 . . . . 62.14 104.551 166.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -104.33 153.18 21.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.97 0.908 . . . . 64.25 110.892 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -133.61 108.37 8.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.866 -1.531 . . . . 75.52 106.866 -171.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.0 t -59.63 -31.95 69.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 119.394 -0.336 . . . . 72.51 111.465 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 -95.02 136.47 35.29 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 124.472 1.109 . . . . 73.24 108.245 171.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.37 -44.65 84.59 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.889 0.875 . . . . 73.51 110.609 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -54.34 -40.69 68.28 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.152 0.581 . . . . 71.25 112.006 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -67.6 -27.1 66.63 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.576 0.75 . . . . 61.55 111.109 -168.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.18 -49.45 75.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 122.259 1.028 . . . . 71.13 108.501 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -71.52 -42.6 67.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 126.139 1.776 . . . . 71.12 109.818 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -68.86 -18.68 64.18 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 121.436 -0.79 . . . . 74.44 111.738 -171.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -77.1 -50.44 13.04 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.138 -0.351 . . . . 75.21 111.156 166.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.415 ' HG3' ' CE1' ' A' ' 79' ' ' TYR . 70.2 mmm -53.56 -58.67 6.32 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.2 1.8 . . . . 52.22 111.912 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.29 -29.53 70.5 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.642 1.577 . . . . 73.23 110.337 -175.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.12 -13.26 59.94 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.355 -0.841 . . . . 34.15 112.894 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -120.35 2.24 10.78 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.261 1.024 . . . . 62.0 111.023 -174.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 57.25 36.43 27.35 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.875 -0.787 . . . . 74.0 108.875 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.0 m170 58.32 23.09 10.07 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 114.79 1.404 . . . . 73.43 114.79 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.0 p -138.11 149.89 46.36 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.946 1.698 . . . . 72.32 109.009 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 73.1 mt -134.8 172.76 12.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.882 0.873 . . . . 75.22 110.163 168.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -145.45 103.99 3.87 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 119.398 -0.334 . . . . 64.3 111.317 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.94 132.55 67.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 107.907 -1.146 . . . . 64.2 107.907 -172.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.1 mp 50.7 26.22 2.42 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.444 1.498 . . . . 73.2 110.692 -168.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.06 -11.61 59.95 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.495 1.521 . . . . 71.02 114.482 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -75.71 134.34 40.55 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.203 2.002 . . . . 75.44 108.382 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -88.3 93.1 9.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.785 1.634 . . . . 71.2 108.413 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 t -78.6 154.58 4.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 126.79 2.036 . . . . 74.11 109.099 -176.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.5 m -121.7 117.79 27.52 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.283 1.433 . . . . 75.22 108.173 170.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.413 ' HB2' HG13 ' A' ' 4' ' ' VAL . 1.1 ptm -84.8 149.49 25.69 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.817 -0.552 . . . . 64.41 109.961 171.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.2 146.65 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.322 1.449 . . . . 75.2 110.175 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 61' ' ' MET . 41.6 m-85 -63.37 128.47 35.97 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 107.567 -1.272 . . . . 75.22 107.567 162.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 t -144.18 53.34 1.28 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.358 0.981 . . . . 55.25 108.98 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -45.01 144.62 1.91 Allowed Pre-proline 0 N--CA 1.464 0.236 0 C-N-CA 125.204 1.402 . . . . 75.12 114.02 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -67.89 -35.57 20.57 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.877 1.718 . . . . 74.14 110.247 -173.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -140.04 158.24 67.58 Favored Pre-proline 0 N--CA 1.451 -0.404 0 C-N-CA 124.523 1.129 . . . . 74.11 110.297 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.06 99.86 1.04 Allowed 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.115 2.543 . . . . 72.45 109.773 173.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -102.94 31.44 4.2 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.255 1.022 . . . . 72.21 110.915 174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.563 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.1 mp -69.91 167.42 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.414 1.485 . . . . 72.41 108.631 172.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -101.71 153.16 20.04 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.304 -1.497 . . . . 71.23 108.143 165.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 44.22 65.66 1.0 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 128.735 2.814 . . . . 72.53 112.712 174.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -73.75 -40.51 63.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.325 0.65 . . . . 74.52 111.216 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 50.9 p-90 -89.34 1.71 55.39 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.374 1.469 . . . . 72.52 112.482 -171.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.25 1.086 0 N-CA-C 105.546 -2.02 . . . . 75.11 105.546 171.911 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.291 4.0 m . . . . . 0 N--CA 1.473 0.72 0 CA-C-O 115.912 -1.994 . . . . 64.24 112.703 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 0.8 OUTLIER 54.13 20.71 2.65 Favored 'General case' 0 C--N 1.349 0.584 0 C-N-CA 127.528 2.331 . . . . 70.53 112.568 -170.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 95.9 mt -141.5 139.49 32.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 105.628 -1.99 . . . . 64.22 105.628 -171.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.2 t -127.61 113.94 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 126.096 1.758 . . . . 72.3 108.397 176.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 mtp -70.8 112.55 7.08 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.347 -1.353 . . . . 73.3 107.347 159.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.0 mt -89.96 89.8 7.88 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 108.256 -1.016 . . . . 62.23 108.256 170.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -73.31 152.98 40.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 120.837 -1.165 . . . . 74.22 110.24 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.6 mtm 75.22 27.6 1.09 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.352 1.861 . . . . 63.23 112.355 168.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 18' ' ' ILE . 5.3 mp -60.68 152.48 67.33 Favored Pre-proline 0 C--O 1.234 0.281 0 O-C-N 121.437 -0.789 . . . . 73.33 109.308 163.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.5 169.7 17.97 Favored 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 122.592 2.195 . . . . 73.21 109.601 163.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -74.54 -28.81 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 121.596 -0.69 . . . . 71.41 111.127 169.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.16 -6.71 55.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.901 0.881 . . . . 74.34 112.57 -176.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.0 146.09 18.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.081 0.953 . . . . 74.4 110.82 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -114.74 172.71 6.87 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.881 0.848 . . . . 70.13 109.189 166.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.3 -38.04 86.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.062 0.945 . . . . 72.44 109.322 171.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.77 -30.69 64.33 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 121.745 -0.597 . . . . 65.32 111.192 -169.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -49.43 -44.53 45.52 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 127.297 2.239 . . . . 53.13 109.869 171.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.418 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -82.08 -36.76 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.991 1.316 . . . . 74.22 109.266 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -56.14 -41.23 75.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.039 0.836 . . . . 74.32 109.577 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.97 -42.42 99.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.561 -0.577 . . . . 65.33 112.452 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -66.1 -31.74 72.78 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 118.92 1.36 . . . . 72.13 111.439 -176.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 29' ' ' ALA . 14.4 mt -69.23 -55.67 9.87 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.332 -0.988 . . . . 72.34 108.332 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 47.0 mm-40 -66.82 -19.09 65.67 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.513 -1.232 . . . . 74.44 112.159 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -55.32 -39.02 69.45 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 120.69 1.586 . . . . 74.44 110.192 169.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.451 ' CD2' HD21 ' A' ' 64' ' ' ASN . 90.5 m-70 -96.54 1.32 51.28 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.1 -1.0 . . . . 74.24 112.547 175.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.32 11.16 64.91 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 123.794 0.711 . . . . 63.11 112.667 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.42 160.25 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.475 -1.676 . . . . 64.12 106.475 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 141.9 51.49 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.173 -1.047 . . . . 72.11 108.173 -176.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.463 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . -83.11 104.51 13.36 Favored 'General case' 0 N--CA 1.424 -1.739 0 N-CA-C 108.672 -0.862 . . . . 52.32 108.672 157.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -37.81 76.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.785 -0.821 . . . . 73.54 108.785 166.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -142.16 152.7 43.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 106.942 -1.503 . . . . 63.34 106.942 176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -170.12 137.78 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.461 0.648 . . . . 62.12 109.557 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.99 84.57 2.25 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 126.54 1.936 . . . . 74.53 107.382 -174.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.78 88.33 2.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.023 0.929 . . . . 73.2 108.608 165.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.5 ptm -168.65 142.33 3.07 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.354 0.979 . . . . 74.2 110.92 154.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -48.76 112.19 0.57 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 125.183 1.393 . . . . 74.1 110.748 -175.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -160.45 106.02 1.49 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.104 0.962 . . . . 71.23 112.088 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 1.6 2.14 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 115.686 1.735 . . . . 71.35 115.686 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.79 -2.1 18.78 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.917 1.687 . . . . 52.23 112.162 -177.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.3 m -131.13 -40.36 1.15 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.757 1.223 . . . . 53.12 109.416 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.71 54.34 2.96 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 107.744 -2.142 . . . . 52.04 107.744 -172.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -91.2 -177.14 4.8 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 124.376 0.692 . . . . 72.5 110.138 168.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.05 -152.81 0.21 Allowed 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.715 -0.616 . . . . 73.44 110.961 164.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.37 -3.14 2.66 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 127.559 2.344 . . . . 74.43 112.947 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 124.4 11.57 4.56 Favored Glycine 0 CA--C 1.52 0.395 0 CA-C-O 118.672 -1.071 . . . . 52.02 112.365 -173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -154.23 160.45 41.82 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 118.961 1.381 . . . . 74.52 110.935 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.68 163.48 14.07 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.181 2.593 . . . . 74.42 108.453 165.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -111.22 124.38 52.1 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 105.321 -2.103 . . . . 72.21 105.321 155.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.66 114.18 42.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 104.85 -2.278 . . . . 54.33 104.85 -172.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -119.57 137.22 53.98 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.9 0.88 . . . . 73.54 110.564 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -112.49 138.4 49.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.801 -1.185 . . . . 64.53 107.801 -169.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.08 -13.99 62.16 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.697 -0.627 . . . . 23.44 110.881 175.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -123.33 117.42 25.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 106.084 -1.821 . . . . 71.54 106.084 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.1 pp -56.47 -33.67 66.16 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.547 0.612 . . . . 73.4 111.778 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -54.31 -37.95 65.4 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.708 1.603 . . . . 61.52 110.686 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -74.67 -22.28 58.96 Favored 'General case' 0 C--O 1.231 0.084 0 O-C-N 121.532 -0.73 . . . . 74.52 111.292 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.47 -55.27 16.43 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 106.981 -1.488 . . . . 52.4 106.981 175.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.4 m -61.63 -33.21 73.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.227 0.611 . . . . 64.54 111.119 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -57.47 -56.95 15.18 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 118.66 0.664 . . . . 65.52 109.467 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -60.14 -44.43 94.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.553 0.533 . . . . 74.5 110.458 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 22.7 mmm -56.88 -59.33 5.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.406 1.482 . . . . 73.21 110.505 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -71.67 -25.8 62.27 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 123.331 0.653 . . . . 70.14 111.823 -171.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.15 -22.17 60.56 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.126 0.421 . . . . 41.22 110.949 176.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.451 HD21 ' CD2' ' A' ' 25' ' ' HIS . 64.0 m-80 -109.26 2.26 20.74 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.427 1.091 . . . . 62.0 111.786 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 61.51 22.18 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.19 0.996 . . . . 71.22 110.632 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.7 m170 72.91 16.73 4.41 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.285 1.834 . . . . 74.31 114.283 -177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.56 131.96 34.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.128 -1.608 . . . . 72.3 109.394 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.3 mt -125.07 172.38 9.5 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.572 1.149 . . . . 74.14 110.52 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -145.59 104.83 3.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.472 -0.936 . . . . 71.22 108.472 -172.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.8 mt -129.09 116.25 39.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 105.548 -2.019 . . . . 74.32 105.548 -163.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.5 mp 55.99 24.95 8.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.202 1.401 . . . . 74.12 110.556 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.36 -12.39 68.27 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.46 1.029 . . . . 61.33 114.084 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.23 138.89 47.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.173 1.487 . . . . 65.42 108.476 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HE3' ' C ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -75.03 111.57 10.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 106.599 -1.63 . . . . 73.32 106.599 170.695 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.407 ' N ' ' HE3' ' A' ' 74' ' ' LYS . 87.5 t -105.61 141.61 20.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 124.382 1.073 . . . . 74.33 108.244 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.4 m -116.69 113.05 22.09 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.087 -1.079 . . . . 74.52 108.087 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -78.57 142.26 37.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.645 -0.872 . . . . 61.22 108.645 168.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -141.74 143.9 33.74 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.616 -1.994 . . . . 72.24 105.616 172.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -63.25 159.03 18.66 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 119.701 1.137 . . . . 74.53 109.755 170.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.7 t -146.9 -159.19 0.99 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.814 -0.81 . . . . 71.42 108.814 160.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -132.05 165.03 38.91 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 128.673 2.789 . . . . 72.5 109.687 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.04 -28.73 10.73 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 121.606 1.537 . . . . 54.23 114.006 -168.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt 54.32 155.15 0.05 OUTLIER Pre-proline 0 C--O 1.239 0.501 0 C-N-CA 129.788 3.235 . . . . 74.54 114.569 -164.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.4 101.99 0.92 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 N-CA-C 107.701 -1.692 . . . . 65.55 107.701 162.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.6 pttm -118.77 15.6 13.52 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 127.066 2.146 . . . . 64.11 112.137 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.698 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.5 mp -67.17 137.16 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 N-CA-C 105.694 -1.965 . . . . 71.15 105.694 164.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.506 HD22 ' HG2' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -68.01 -5.78 19.11 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.302 1.223 . . . . 70.41 114.302 175.429 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.506 ' HG2' HD22 ' A' ' 87' ' ' ASN . 6.0 mm-40 -143.36 122.36 12.81 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 126.913 2.085 . . . . 72.44 106.975 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.71 5.61 47.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.818 1.247 . . . . 74.51 111.705 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 46.7 p-90 -135.84 6.97 3.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 125.461 1.504 . . . . 74.34 112.762 -173.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--O 1.248 1.018 0 CA-C-O 115.393 -2.241 . . . . 71.23 108.521 -179.986 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . 0.275 19.5 m . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 116.34 -1.79 . . . . 45.43 110.482 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 44.33 37.4 1.97 Allowed 'General case' 0 C--N 1.351 0.646 0 C-N-CA 126.214 1.805 . . . . 73.33 109.912 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -135.27 142.16 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 102.775 -3.046 . . . . 74.31 102.775 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.8 t -120.1 123.36 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 N-CA-C 103.357 -2.831 . . . . 72.21 103.357 165.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.77 117.24 33.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 105.227 -2.138 . . . . 64.34 105.227 -176.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -105.37 94.11 5.04 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.333 -1.358 . . . . 73.34 107.333 -165.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -77.34 161.51 28.0 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 119.067 0.849 . . . . 73.14 110.591 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm 72.72 21.47 3.45 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.368 1.867 . . . . 74.02 112.814 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tp -68.35 143.43 95.59 Favored Pre-proline 0 C--O 1.236 0.347 0 CA-C-O 118.731 -0.652 . . . . 63.32 109.858 -174.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.52 158.73 43.75 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.16 1.907 . . . . 72.15 111.216 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -77.53 1.58 18.99 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.185 -1.37 . . . . 74.23 110.972 178.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -110.39 -20.43 12.61 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.178 1.391 . . . . 70.43 113.823 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.4 164.48 16.15 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.689 1.132 . . . . 64.24 110.859 -177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 66.2 p -129.22 168.14 16.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.849 1.26 . . . . 73.01 111.845 -176.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.74 -45.12 49.01 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.411 1.485 . . . . 72.35 110.488 172.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.19 -23.36 51.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.481 -0.781 . . . . 65.54 111.845 -173.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -57.88 -50.73 72.33 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.156 1.382 . . . . 62.01 109.286 172.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.426 HD11 HD23 ' A' ' 34' ' ' LEU . 30.9 mt -63.77 -46.78 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 109.191 -0.67 . . . . 74.45 109.191 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -58.84 -38.18 78.11 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.399 -0.813 . . . . 73.35 111.369 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -39.18 95.3 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 111.374 -0.691 . . . . 73.44 111.374 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.19 -6.19 22.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.54 1.17 . . . . 72.35 112.376 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.801 HD13 ' HB2' ' A' ' 29' ' ' ALA . 35.4 mt -102.85 -44.36 5.29 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.388 0.994 . . . . 74.42 110.923 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -46.7 -47.67 20.4 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.897 0.479 . . . . 64.11 111.858 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 12.14 18.01 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.684 0.794 . . . . 74.33 112.795 -171.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -110.01 -8.05 14.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.247 0.931 . . . . 74.23 111.687 163.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 106.69 17.57 11.92 Favored Glycine 0 C--O 1.227 -0.301 0 N-CA-C 109.126 -1.59 . . . . 74.01 109.126 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.18 162.89 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 C-N-CA 125.889 1.675 . . . . 73.41 109.141 -171.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -136.64 -16.05 1.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.581 0.956 . . . . 71.44 113.581 -149.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.801 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 45.22 92.21 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.368 2.667 . . . . 73.23 114.317 -170.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -76.12 -27.22 56.99 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.844 -0.598 . . . . 74.14 112.15 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -149.64 139.37 21.76 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.147 0.885 . . . . 73.44 108.614 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.444 HG12 ' HB1' ' A' ' 29' ' ' ALA . 2.8 m -141.94 145.92 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.007 -1.058 . . . . 72.15 111.674 -167.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -142.34 74.01 1.43 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.832 1.253 . . . . 72.23 109.574 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD22 ' H ' ' A' ' 35' ' ' MET . 1.7 tm? -84.14 159.31 21.1 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.05 0.94 . . . . 71.22 109.986 172.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.651 ' H ' HD22 ' A' ' 34' ' ' LEU . 66.6 mtp -46.18 77.17 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 131.456 3.903 . . . . 71.44 114.479 170.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 45.5 mtp180 -131.18 -67.04 0.72 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 108.428 -0.952 . . . . 72.34 108.428 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.51 116.25 5.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.646 1.178 . . . . 72.53 108.705 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.7 -23.74 29.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.519 0.933 . . . . 63.51 113.519 171.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.6 t -86.17 -24.29 26.2 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.488 1.04 . . . . 70.21 111.5 -175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -81.0 -63.47 1.4 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.048 -1.032 . . . . 71.25 110.356 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 131.96 2.63 4.22 Favored Glycine 0 N--CA 1.466 0.659 0 CA-C-O 119.868 -0.407 . . . . 70.03 113.136 -165.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -69.58 14.45 0.1 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.849 1.659 . . . . 42.03 111.906 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 p -133.7 98.72 4.26 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.44 1.896 . . . . 74.24 111.124 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.53 13.34 0.64 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.928 1.455 . . . . 70.15 114.928 -176.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.83 21.93 56.6 Favored Glycine 0 N--CA 1.467 0.708 0 CA-C-N 120.525 1.511 . . . . 62.42 111.875 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -143.36 -178.62 5.96 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.522 1.129 . . . . 74.43 108.997 164.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.7 168.13 20.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.663 -0.865 . . . . 50.44 108.663 163.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -124.8 107.96 11.46 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 104.285 -2.487 . . . . 70.31 104.285 169.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.9 p -88.9 150.05 3.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.23 -1.396 . . . . 70.44 107.23 163.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -125.0 126.69 45.84 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.122 2.169 . . . . 74.2 106.687 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -107.1 151.36 25.48 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.148 -1.056 . . . . 65.1 108.148 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 m -73.28 -16.76 61.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.324 -0.846 . . . . 74.54 113.005 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -132.83 137.71 46.84 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 119.864 1.211 . . . . 73.33 111.025 -173.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.41 -26.69 68.09 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.55 -0.75 . . . . 64.32 111.681 173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.85 -32.55 69.61 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.479 1.036 . . . . 64.3 111.667 173.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -63.38 -36.3 83.27 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 107.72 -1.215 . . . . 74.11 107.72 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.59 -50.96 71.84 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 124.075 0.95 . . . . 52.44 109.023 -175.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.92 80.19 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 119.188 -0.434 . . . . 74.21 111.234 177.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -58.5 -36.02 73.14 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.195 0.452 . . . . 72.14 110.208 -176.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -69.49 -67.42 0.48 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.429 -0.796 . . . . 72.13 109.714 165.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.8 mtp -55.55 -51.54 66.74 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.299 0.954 . . . . 71.44 113.573 -161.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.53 -39.66 80.76 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.473 0.709 . . . . 64.23 110.252 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.65 -2.82 24.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.432 1.093 . . . . 71.41 113.316 -173.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -123.63 9.22 8.94 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.647 1.179 . . . . 71.03 113.073 168.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 61.8 32.5 18.13 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.052 0.842 . . . . 51.3 109.706 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.3 m170 62.08 9.06 2.89 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 115.186 1.55 . . . . 70.4 115.186 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.61 104.26 7.34 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.568 1.531 . . . . 51.45 110.996 -179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.1 mt -85.51 173.68 10.04 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.317 0.58 . . . . 70.33 109.485 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -146.74 98.68 3.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 108.938 -0.764 . . . . 65.44 108.938 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 mp -114.0 128.93 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 108.714 -0.847 . . . . 65.25 108.714 -176.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt 50.0 33.65 7.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 126.546 1.938 . . . . 70.43 110.328 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.2 -12.8 57.41 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 117.868 -1.518 . . . . 51.33 114.762 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.51 140.87 37.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 120.748 2.274 . . . . 74.32 108.035 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -65.63 140.34 58.49 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 106.177 -1.786 . . . . 74.14 106.177 166.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 43.6 t -127.72 152.38 35.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 105.742 -1.948 . . . . 65.32 105.742 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.8 p -127.39 139.98 52.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.288 0.495 . . . . 74.05 110.09 171.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.06 151.03 25.89 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 122.352 1.072 . . . . 74.13 112.476 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -143.67 129.34 19.23 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.74 2.016 . . . . 73.02 106.792 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -57.97 135.56 56.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 106.943 -1.503 . . . . 73.2 106.943 158.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.6 t -142.97 171.67 13.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 107.064 -1.458 . . . . 61.2 107.064 173.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -129.28 150.82 76.57 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.174 -1.417 . . . . 73.31 107.174 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.95 -25.01 20.19 Favored 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.114 1.876 . . . . 74.34 114.856 -160.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 84' ' ' PRO . 8.8 ptmt 60.99 163.35 0.1 Allowed Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 130.223 3.409 . . . . 65.44 113.193 -170.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.445 ' O ' ' HE2' ' A' ' 83' ' ' LYS . 56.2 Cg_endo -71.67 103.52 1.46 Allowed 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 122.089 1.86 . . . . 74.54 108.145 166.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -89.97 62.89 5.77 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 123.353 1.549 . . . . 44.22 110.0 -170.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.3 mm -93.57 164.97 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.071 -1.455 . . . . 63.5 107.071 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -80.64 135.0 35.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.998 -1.482 . . . . 61.11 106.998 161.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 44.07 56.91 4.49 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 127.523 2.329 . . . . 72.15 111.901 158.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -78.59 -4.67 49.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 113.569 -1.651 . . . . 73.43 113.342 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 36.3 p-90 -123.71 9.88 8.95 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 128.151 2.58 . . . . 72.31 111.353 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.253 1.279 0 N-CA-C 104.214 -2.513 . . . . 74.23 104.214 161.395 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 111.804 0.298 . . . . 64.13 111.804 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -135.56 22.73 3.4 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.459 1.504 . . . . 73.34 110.624 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -125.49 138.22 55.11 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 107.697 -1.223 . . . . 64.55 107.697 168.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.9 72.87 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 124.949 1.405 . . . . 70.45 107.724 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -72.98 155.36 39.92 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.668 -1.234 . . . . 64.43 107.668 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.5 mt -135.46 107.88 7.34 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.059 0.944 . . . . 74.31 110.403 -165.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.451 HH11 ' CE1' ' A' ' 78' ' ' HIS . 42.4 mtp180 -87.9 -2.55 58.68 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 115.052 1.501 . . . . 74.42 115.052 -165.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.4 mtm -135.91 62.52 1.62 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.557 1.143 . . . . 74.15 110.01 -169.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -101.29 144.07 27.84 Favored Pre-proline 0 C--O 1.235 0.33 0 N-CA-C 112.083 0.401 . . . . 72.14 112.083 -177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.55 150.05 68.99 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.291 2.661 . . . . 64.12 112.279 167.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -78.13 13.55 1.43 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.733 2.413 . . . . 51.43 111.692 176.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.25 -13.9 4.92 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.478 0.918 . . . . 75.12 113.478 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.63 152.64 41.64 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 119.494 1.043 . . . . 73.35 109.489 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.8 p -106.28 165.53 11.18 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 123.899 0.879 . . . . 75.51 110.022 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' HD22 ' A' ' 34' ' ' LEU . 23.8 tt0 -59.2 -34.01 71.65 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 121.443 -0.785 . . . . 64.43 109.719 172.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -63.15 -35.42 80.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.348 2.659 . . . . 75.44 111.708 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -58.01 -49.1 78.01 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.818 -0.808 . . . . 63.34 108.818 175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 77.9 mt -71.88 -39.39 67.37 Favored 'Isoleucine or valine' 0 C--N 1.339 0.146 0 CA-C-O 118.74 -0.648 . . . . 65.14 110.067 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -52.93 -35.22 58.17 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.658 1.117 . . . . 64.42 110.106 174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.01 12.13 58.93 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.78 1.657 . . . . 61.23 113.945 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -97.09 -0.53 46.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 119.277 1.538 . . . . 72.31 110.505 158.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 23.4 mt -102.83 -38.31 7.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.771 1.169 . . . . 62.42 111.232 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.68 -35.9 79.31 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.92 1.081 . . . . 53.41 113.92 -170.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 m -73.11 -8.21 54.76 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 117.675 -1.155 . . . . 74.24 112.482 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -103.16 -7.31 21.36 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 121.337 1.881 . . . . 74.55 111.808 170.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.25 -11.96 67.97 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 124.562 1.077 . . . . 52.02 112.303 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -54.54 161.1 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 123.349 1.547 . . . . 65.52 114.346 156.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.403 ' NE2' ' H ' ' A' ' 28' ' ' GLN . 0.2 OUTLIER -128.1 148.8 50.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.519 2.328 . . . . 72.34 107.224 167.013 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.84 101.84 12.6 Favored 'General case' 0 N--CA 1.422 -1.855 0 N-CA-C 108.277 -1.009 . . . . 65.31 108.277 153.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -67.37 -54.67 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 121.849 -0.532 . . . . 74.25 109.885 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -132.65 157.32 45.12 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.149 0.98 . . . . 72.42 109.793 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.264 1.5 p -167.51 151.18 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 O-C-N 121.634 -0.666 . . . . 71.45 111.75 -172.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -133.95 94.32 3.24 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.31 2.644 . . . . 65.03 107.376 173.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.589 HD23 ' N ' ' A' ' 35' ' ' MET . 4.7 tt -109.22 -173.86 2.37 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.082 0.953 . . . . 63.55 108.766 164.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.589 ' N ' HD23 ' A' ' 34' ' ' LEU . 30.3 mtp -48.19 130.97 16.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 126.938 2.095 . . . . 75.32 110.354 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.87 -56.79 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.983 2.513 . . . . 63.25 108.327 171.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -77.27 -11.54 59.84 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.041 -0.981 . . . . 64.32 112.577 -159.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.322 0.0 OUTLIER 44.39 -66.82 0.0 OUTLIER 'General case' 0 C--N 1.345 0.398 0 C-N-CA 130.867 3.667 . . . . 73.21 114.267 -170.554 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.6 t -60.98 -54.05 49.76 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.093 2.557 . . . . 75.31 110.032 -166.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 t -55.15 -35.72 65.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.955 0.502 . . . . 75.42 111.991 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 123.89 7.2 6.76 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 118.412 0.551 . . . . 64.23 113.202 167.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -64.69 14.28 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.03 2.132 . . . . 75.32 112.599 177.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.0 t -140.91 85.43 1.99 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.824 2.05 . . . . 54.15 105.942 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmt180 -145.17 7.92 1.19 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.182 2.193 . . . . 72.51 110.958 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.28 18.59 38.6 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 119.668 1.122 . . . . 71.33 113.208 -176.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -146.91 163.69 35.33 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 118.466 1.133 . . . . 52.12 112.496 171.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -138.92 170.24 16.34 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.327 1.051 . . . . 72.41 108.881 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -136.76 121.21 18.2 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.55 2.34 . . . . 73.43 104.805 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 p -117.84 121.37 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 105.693 -1.965 . . . . 73.42 105.693 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -108.0 106.7 17.06 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.453 1.501 . . . . 72.24 110.29 -174.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -80.38 178.14 8.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.59 0.756 . . . . 74.41 111.813 -164.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.43 -26.51 24.67 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.219 -0.895 . . . . 70.14 112.019 168.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -141.99 145.39 34.39 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.7 1.136 . . . . 74.05 112.702 -168.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.25 -41.27 98.28 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.938 1.295 . . . . 63.11 112.373 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -67.56 -32.8 73.8 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.891 0.769 . . . . 71.31 109.833 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.16 -33.16 75.16 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.162 0.985 . . . . 73.21 110.819 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.54 -50.57 73.38 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 122.265 1.031 . . . . 62.52 108.329 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.929 2.091 . . . . 63.12 111.696 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -56.68 -46.39 81.18 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 124.459 1.104 . . . . 73.54 109.428 -177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -65.61 -49.14 69.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.658 -0.687 . . . . 72.43 110.435 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.415 ' SD ' ' HG3' ' A' ' 77' ' ' MET . 11.5 mmm -51.87 -65.5 0.55 Allowed 'General case' 0 C--N 1.343 0.313 0 C-N-CA 124.217 1.007 . . . . 53.34 111.571 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -64.9 -38.8 92.17 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.033 0.533 . . . . 71.15 109.963 -167.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.58 -23.4 63.53 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 118.198 -0.906 . . . . 52.04 112.281 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -99.21 8.84 44.44 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 118.891 0.769 . . . . 64.35 110.92 174.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 60.42 21.6 11.22 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.867 -1.146 . . . . 65.52 111.408 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.6 m170 66.13 23.18 11.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.841 2.457 . . . . 74.41 113.977 -171.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 p -145.61 116.35 7.7 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 120.116 1.326 . . . . 72.12 110.236 168.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -76.41 179.94 5.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.054 0.542 . . . . 70.23 110.301 174.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -142.72 101.57 3.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.953 -0.546 . . . . 74.42 109.983 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -124.67 134.04 67.83 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 C-N-CA 125.409 1.484 . . . . 70.45 108.149 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.18 17.18 2.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.864 2.065 . . . . 74.23 111.334 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.78 -9.12 75.35 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.394 0.997 . . . . 73.25 112.771 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.9 140.84 39.33 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 119.405 1.603 . . . . 62.21 109.219 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -73.2 117.7 15.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.45 -1.315 . . . . 73.11 107.45 167.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.6 t -111.64 130.0 66.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 105.93 -1.878 . . . . 54.21 105.93 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.5 p -82.44 158.51 23.23 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.763 -0.829 . . . . 64.22 108.763 174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' SD ' ' A' ' 61' ' ' MET . 5.4 ptm -132.55 139.77 48.0 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.983 0.913 . . . . 72.41 109.173 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.451 ' CE1' HH11 ' A' ' 7' ' ' ARG . 37.6 m-70 -144.98 145.59 31.59 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.345 1.458 . . . . 62.24 110.399 -172.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -77.09 81.05 3.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.78 1.232 . . . . 73.41 110.046 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -88.13 57.17 4.16 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.373 -0.83 . . . . 62.52 108.767 171.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -49.87 154.73 1.72 Allowed Pre-proline 0 N--CA 1.471 0.579 0 C-N-CA 124.238 1.015 . . . . 64.35 112.246 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -66.25 -39.63 17.26 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 121.459 1.439 . . . . 65.22 110.473 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.406 ' HE3' ' HD2' ' A' ' 85' ' ' LYS . 28.9 pttt 55.77 165.79 0.06 OUTLIER Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 128.635 2.774 . . . . 73.54 112.693 -171.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.47 101.73 0.45 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 N-CA-C 108.029 -1.566 . . . . 65.31 108.029 165.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' HD2' ' HE3' ' A' ' 83' ' ' LYS . 5.0 tptm -105.67 17.25 24.07 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.977 1.711 . . . . 72.23 111.701 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.4 mp -71.14 166.49 2.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 125.649 1.58 . . . . 72.14 107.889 -176.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -162.02 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.735 1.214 . . . . 63.25 110.663 158.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 117.56 5.63 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 119.798 -1.814 . . . . 65.35 110.432 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.86 -0.91 29.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.145 2.178 . . . . 74.42 112.91 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -122.14 6.84 9.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.831 1.652 . . . . 74.35 111.522 176.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.25 1.087 0 N-CA-C 105.746 -1.946 . . . . 74.45 105.746 163.563 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 118.51 -0.757 . . . . 73.02 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -122.21 1.2 9.68 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.582 1.953 . . . . 71.12 113.275 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.5 mt -92.29 139.76 17.37 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 N-CA-C 106.493 -1.669 . . . . 70.1 106.493 170.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.1 t -117.79 103.52 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 102.952 -2.981 . . . . 73.21 102.952 166.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.0 ttm -76.99 130.4 37.42 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 105.866 -1.901 . . . . 74.31 105.866 170.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 111.92 24.68 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.124 -1.806 . . . . 72.34 106.124 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 164.75 11.45 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.59 1.556 . . . . 71.33 108.724 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.0 mtm 60.58 34.17 20.28 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.595 1.158 . . . . 73.43 110.825 -171.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 147.54 99.08 Favored Pre-proline 0 C--O 1.243 0.716 0 O-C-N 120.895 -1.128 . . . . 71.32 108.105 174.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.1 170.79 11.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.008 1.806 . . . . 65.34 110.055 165.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -80.74 -25.35 38.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.233 -0.894 . . . . 74.13 110.475 169.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.74 40.16 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 114.666 1.358 . . . . 51.43 114.666 -169.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 161.26 8.96 Favored 'General case' 0 N--CA 1.463 0.218 0 O-C-N 123.731 0.644 . . . . 71.32 111.494 -170.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 60.3 p -122.71 166.61 14.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.641 1.176 . . . . 72.11 108.977 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -53.66 -41.58 66.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.346 0.659 . . . . 63.54 109.701 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.36 -27.01 67.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.962 1.305 . . . . 75.23 112.327 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.64 -52.25 61.62 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.675 0.79 . . . . 74.31 109.043 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.8 mt -68.15 -43.36 85.07 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 N-CA-C 108.703 -0.851 . . . . 72.22 108.703 -177.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 26.6 mtp85 -54.97 -33.48 62.47 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 118.903 -0.57 . . . . 75.52 110.325 174.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.61 -44.5 49.32 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.561 1.077 . . . . 64.31 112.833 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.74 -12.96 27.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.716 1.206 . . . . 73.4 112.538 175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.1 mt -97.46 -52.97 3.6 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.94 1.696 . . . . 71.31 110.275 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -61.81 -22.8 65.77 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.318 -0.553 . . . . 74.4 110.596 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 m -48.98 -55.16 12.74 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-O 117.479 -1.248 . . . . 75.51 111.972 163.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HG22 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -98.75 -9.25 24.76 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 115.6 -2.44 . . . . 75.5 109.752 -156.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.47 31.68 2.52 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 124.328 0.966 . . . . 51.34 111.455 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -125.93 170.98 15.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-O 122.622 1.201 . . . . 71.34 110.967 -178.417 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -125.28 139.61 53.56 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 126.888 2.075 . . . . 74.32 106.226 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.82 92.75 8.72 Favored 'General case' 0 N--CA 1.428 -1.533 0 O-C-N 121.491 -0.755 . . . . 75.21 109.615 156.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -22.57 61.52 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.704 -0.623 . . . . 74.2 112.548 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -146.23 170.0 17.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.158 -0.964 . . . . 73.15 108.547 152.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.29 1.3 p -162.69 146.64 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 126.896 2.078 . . . . 73.32 110.534 174.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -129.18 82.92 2.11 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 128.635 2.774 . . . . 73.41 106.055 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 35' ' ' MET . 2.2 tm? -91.5 167.85 11.95 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 107.986 -1.116 . . . . 73.3 107.986 173.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.495 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.0 mpp? -55.25 16.96 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.861 2.864 . . . . 63.43 117.382 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.7 mtp85 -130.02 105.11 7.74 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.114 -1.617 . . . . 70.24 108.724 172.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -154.04 135.18 13.97 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.862 1.265 . . . . 72.54 111.096 168.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -52.79 -51.36 61.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.231 1.413 . . . . 74.41 110.888 170.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -23.21 65.46 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 115.727 1.751 . . . . 42.12 115.727 -168.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.3 -25.26 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.243 0.929 . . . . 63.34 112.872 -177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.76 -27.07 12.67 Favored Glycine 0 C--O 1.225 -0.434 0 CA-C-O 118.796 -1.002 . . . . 71.11 112.015 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 45.84 31.75 1.12 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.985 2.514 . . . . 72.23 113.107 -175.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -115.64 97.93 6.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.662 1.585 . . . . 74.31 110.716 -150.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.3 mtt85 -148.46 -5.09 0.44 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 115.296 1.591 . . . . 71.34 115.296 -176.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.85 12.74 56.35 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 121.025 1.739 . . . . 43.33 111.314 -173.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -143.04 163.63 32.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.065 0.946 . . . . 74.23 109.076 163.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.11 170.38 16.19 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 126.416 1.886 . . . . 53.42 108.842 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -137.42 97.73 3.54 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.348 1.859 . . . . 65.33 106.679 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.3 p -83.19 146.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.079 -0.711 . . . . 73.43 109.079 171.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.87 132.58 56.11 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 125.097 1.359 . . . . 74.43 108.681 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -110.49 152.28 26.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.636 1.174 . . . . 72.4 109.55 -176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.1 m -66.98 -22.46 65.92 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.704 0.631 . . . . 72.3 112.704 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -137.61 125.15 22.11 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.667 0.667 . . . . 73.13 110.482 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.4 pp -51.54 -31.58 24.75 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.412 1.085 . . . . 75.41 112.421 165.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -40.16 84.89 Favored 'General case' 0 C--O 1.233 0.202 0 O-C-N 121.677 -0.639 . . . . 72.52 110.972 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -75.64 -23.22 56.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 118.738 -0.648 . . . . 73.33 109.951 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.97 -51.02 69.78 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 107.087 -1.449 . . . . 52.2 107.087 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -32.6 73.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 119.016 -0.516 . . . . 73.32 111.698 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -41.6 86.89 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.095 -0.706 . . . . 74.54 109.095 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.498 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 3.6 t90 -68.54 -51.46 42.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 118.93 0.786 . . . . 72.22 110.463 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -54.44 45.1 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 123.358 0.663 . . . . 62.22 110.098 -171.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.73 -40.59 95.6 Favored 'General case' 0 CA--C 1.522 -0.133 0 CA-C-N 118.47 0.577 . . . . 74.3 110.963 -177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.08 -1.11 30.79 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.687 0.625 . . . . 73.02 112.687 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -128.89 7.49 5.6 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.395 1.478 . . . . 71.1 110.089 175.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 49.71 31.9 4.73 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.383 1.873 . . . . 73.04 112.101 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 m170 75.32 9.2 3.81 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 128.258 2.623 . . . . 71.34 114.908 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.97 125.58 37.74 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.359 2.263 . . . . 62.22 109.768 -170.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 45.8 mt -123.16 174.62 7.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.419 1.888 . . . . 71.34 110.624 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -144.03 94.41 2.58 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 106.302 -1.74 . . . . 73.21 106.302 -174.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.89 123.85 67.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 123.903 0.881 . . . . 63.12 109.394 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt 58.45 20.89 7.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.166 2.587 . . . . 53.43 113.226 175.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 98.41 -4.83 60.33 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.847 1.689 . . . . 71.0 115.714 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.97 148.79 24.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 119.795 1.797 . . . . 74.43 108.935 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -79.48 135.09 36.55 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 107.523 -1.288 . . . . 73.04 107.523 166.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.1 t -130.5 142.06 44.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.898 -1.149 . . . . 65.2 107.898 -172.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 63.5 p -115.79 141.62 47.85 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.128 0.971 . . . . 54.42 110.597 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -108.75 139.92 42.89 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.72 0.808 . . . . 52.52 110.617 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -143.34 153.28 42.57 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.617 1.167 . . . . 74.2 110.946 -176.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -84.33 77.82 9.92 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.075 1.35 . . . . 74.33 110.218 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.7 t -84.03 70.64 10.51 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.148 -1.056 . . . . 71.22 108.148 173.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.52 163.5 14.85 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 112.903 0.705 . . . . 73.02 112.903 -168.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.74 -24.94 9.73 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 121.414 1.409 . . . . 62.41 113.214 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 42.8 pttt 54.13 165.84 0.05 OUTLIER Pre-proline 0 C--N 1.343 0.3 0 C-N-CA 129.736 3.214 . . . . 74.14 115.264 -173.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -67.46 105.41 1.06 Allowed 'Trans proline' 0 N--CA 1.444 -1.404 0 N-CA-C 107.363 -1.822 . . . . 65.32 107.363 159.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -112.79 21.55 15.41 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.815 1.246 . . . . 71.24 110.991 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.521 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.1 mp -72.52 144.44 13.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.121 -1.066 . . . . 74.14 108.121 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.02 113.97 8.6 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.611 -1.255 . . . . 70.55 107.611 169.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.88 67.38 0.75 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 128.789 2.836 . . . . 72.01 114.253 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.73 -24.82 67.88 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.922 1.289 . . . . 71.33 113.736 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 68.8 p-90 -106.2 4.79 29.3 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 121.337 -0.852 . . . . 72.41 113.262 -174.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.243 0.738 0 N-CA-C 107.247 -1.39 . . . . 64.24 107.247 163.065 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 118.643 -0.694 . . . . 71.31 110.137 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -132.37 28.43 4.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.04 0.837 . . . . 70.32 111.271 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.1 mt -132.82 133.46 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 107.77 -1.196 . . . . 63.12 107.77 175.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t -119.29 115.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 105.098 -2.186 . . . . 62.02 105.098 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.6 mtp -81.64 126.2 31.48 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 105.957 -1.868 . . . . 74.54 105.957 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -107.24 102.99 12.26 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.024 -1.473 . . . . 61.44 107.024 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.2 mtp180 -90.16 169.03 11.49 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.632 0.773 . . . . 63.54 111.165 -176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 75.23 19.44 2.24 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.235 1.814 . . . . 61.34 112.382 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -69.37 143.91 94.01 Favored Pre-proline 0 CA--C 1.535 0.368 0 O-C-N 120.881 -1.137 . . . . 35.34 111.204 -165.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.6 150.72 51.51 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.111 2.54 . . . . 73.51 109.675 171.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -60.11 -23.75 64.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.078 0.951 . . . . 74.21 112.134 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -94.71 -5.2 46.0 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 117.332 -1.318 . . . . 74.5 113.433 -174.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 163.82 3.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.918 1.69 . . . . 75.41 110.762 170.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.6 p -140.35 -171.48 3.22 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.158 1.783 . . . . 50.22 109.462 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.583 ' N ' HD23 ' A' ' 34' ' ' LEU . 1.7 tt0 -62.13 -38.88 90.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 124.432 1.093 . . . . 74.45 109.497 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.12 -32.09 69.94 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 121.688 0.756 . . . . 71.32 111.116 -172.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.47 -9.84 21.37 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.314 1.845 . . . . 73.04 113.154 171.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.05 -46.47 9.96 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 105.879 -1.897 . . . . 64.41 105.879 167.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' HA ' HD21 ' A' ' 22' ' ' LEU . 36.1 mtt-85 -63.48 -24.21 67.73 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.122 0.786 . . . . 74.12 113.122 -169.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.94 -9.35 66.0 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 118.534 -1.148 . . . . 41.25 113.909 173.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.33 -30.09 23.98 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 119.948 1.874 . . . . 74.24 110.727 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.634 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.0 OUTLIER -86.22 -38.27 17.79 Favored 'General case' 0 CA--C 1.506 -0.732 0 O-C-N 121.602 -0.687 . . . . 74.21 109.244 -162.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -46.65 -45.01 18.94 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 113.323 -1.762 . . . . 64.44 111.454 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 m -53.65 -37.77 63.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.076 0.769 . . . . 65.02 113.076 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -87.24 -15.56 37.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.256 1.422 . . . . 74.51 113.272 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.23 -2.48 33.09 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.214 1.388 . . . . 62.42 112.863 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.754 HG11 ' CE2' ' A' ' 51' ' ' PHE . 2.2 t -80.56 168.76 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 O-C-N 121.157 -1.202 . . . . 73.01 109.439 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -97.52 -33.84 11.21 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.887 -1.054 . . . . 74.04 112.5 162.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.626 ' H ' HG12 ' A' ' 27' ' ' VAL . . . 47.07 119.38 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.101 1.761 . . . . 43.41 112.137 -146.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttt85 -70.96 -56.47 6.14 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 120.878 -1.139 . . . . 74.24 109.714 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -132.26 151.74 51.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.819 -0.808 . . . . 65.01 108.819 -173.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -145.39 89.29 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 125.031 1.333 . . . . 70.01 107.948 -165.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -78.74 83.67 4.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 105.941 -1.874 . . . . 75.21 105.941 167.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD23 ' N ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -64.43 -153.63 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.729 3.211 . . . . 71.12 111.624 173.264 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . 0.304 0.8 OUTLIER -94.49 -70.51 0.7 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 115.807 1.781 . . . . 63.31 115.807 166.497 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -68.56 104.98 2.09 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 124.076 1.893 . . . . 63.01 111.567 -169.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.56 156.7 28.52 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 111.834 -2.439 . . . . 64.41 107.063 177.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.02 -25.48 2.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.666 -0.683 . . . . 73.14 112.49 165.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 t -68.93 -33.95 74.57 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 123.334 0.396 . . . . 62.3 110.555 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.1 m -107.45 -28.82 9.59 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.231 1.197 . . . . 71.3 114.231 -162.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 109.89 11.64 20.28 Favored Glycine 0 C--N 1.34 0.759 0 C-N-CA 123.797 0.713 . . . . 74.32 113.088 167.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -73.32 -174.76 1.7 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 117.348 0.574 . . . . 72.41 111.449 -173.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 77.64 97.01 0.06 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 129.376 3.07 . . . . 63.04 113.51 -172.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -137.87 -3.77 1.81 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.423 1.889 . . . . 51.33 114.426 171.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.48 10.18 60.82 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 120.556 1.526 . . . . 75.22 111.49 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -147.66 152.33 37.67 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 121.741 -0.858 . . . . 72.22 109.198 162.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.68 163.62 13.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.674 -1.232 . . . . 61.22 107.674 168.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -123.67 120.06 31.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 105.262 -2.125 . . . . 74.14 105.262 167.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.452 HG11 ' CZ3' ' A' ' 60' ' ' TRP . 14.1 p -111.12 120.23 61.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 107.464 -1.31 . . . . 71.34 107.464 174.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -93.71 127.49 39.45 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.548 -1.279 . . . . 74.41 107.548 172.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.754 ' CE2' HG11 ' A' ' 27' ' ' VAL . 3.6 m-85 -97.71 146.34 25.45 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.742 1.617 . . . . 71.41 109.604 -178.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.4 m -69.9 -15.77 63.12 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.711 1.004 . . . . 72.24 113.711 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -141.42 127.65 19.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 107.355 -1.35 . . . . 73.44 107.355 -171.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.67 -40.04 86.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.672 0.749 . . . . 63.11 109.034 174.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.03 -43.49 81.96 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 127.079 2.152 . . . . 71.25 111.983 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.47 -25.93 62.49 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 121.6 -0.687 . . . . 74.34 110.323 -177.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.93 -41.78 95.25 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.915 -1.143 . . . . 24.02 107.915 -173.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 m -64.33 -39.26 93.54 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.084 1.753 . . . . 74.42 111.175 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.6 ttm-85 -57.46 -37.56 73.08 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.598 0.635 . . . . 74.34 109.939 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.634 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -67.07 -49.6 64.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 119.028 -0.511 . . . . 61.15 110.929 175.193 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.5 mmm -52.46 -61.69 2.12 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 125.283 1.433 . . . . 54.43 110.629 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.39 -51.7 68.37 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.369 1.868 . . . . 72.35 110.247 -168.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.15 -39.88 93.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.58 1.152 . . . . 70.21 110.295 -171.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -84.42 0.87 47.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.586 -0.733 . . . . 71.32 111.355 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 53.52 44.63 29.62 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.726 1.148 . . . . 64.45 108.117 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 24.1 m170 53.53 15.78 0.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.836 2.054 . . . . 71.11 114.781 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -128.6 112.21 14.04 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 120.106 -1.622 . . . . 54.23 109.953 -177.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.39 174.94 7.12 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 109.096 -0.705 . . . . 34.52 109.096 169.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -149.57 105.1 3.41 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.54 1.136 . . . . 34.33 110.055 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.3 mp -123.06 128.05 74.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 125.689 1.596 . . . . 74.35 107.128 -173.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt 50.91 32.59 7.54 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.961 1.304 . . . . 52.04 110.369 -173.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.73 -9.66 28.85 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-O 118.173 -1.348 . . . . 35.11 115.101 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -75.73 135.66 40.34 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 120.864 2.332 . . . . 75.54 107.904 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.6 tptp -64.66 135.46 55.93 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.194 -1.78 . . . . 74.15 106.194 168.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 67.6 t -123.94 155.24 30.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 105.534 -2.024 . . . . 72.44 105.534 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.4 p -122.4 148.37 45.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.636 0.775 . . . . 73.33 109.892 173.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 ptm -123.58 138.14 54.61 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.812 1.245 . . . . 63.55 110.905 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -143.89 147.66 34.33 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.469 1.108 . . . . 72.24 110.354 -170.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -78.67 72.11 5.18 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.958 1.703 . . . . 64.42 110.964 -175.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 54.87 1.73 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.05 1.34 . . . . 74.14 112.752 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.68 156.69 4.45 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 123.759 0.824 . . . . 51.35 111.068 177.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -74.1 -24.83 14.46 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.761 2.308 . . . . 72.1 114.209 -161.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -158.48 162.22 27.12 Favored Pre-proline 0 C--O 1.236 0.386 0 C-N-CA 126.43 1.892 . . . . 72.44 108.69 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.28 105.21 1.53 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.471 2.114 . . . . 72.31 107.562 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -120.38 55.91 1.0 Allowed 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.89 1.276 . . . . 74.03 110.814 -169.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.541 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -87.34 155.51 3.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 126.672 1.989 . . . . 70.44 107.737 171.528 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -71.26 137.3 48.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 106.352 -1.722 . . . . 73.12 106.352 159.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 45.32 56.07 5.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.291 1.519 . . . . 44.43 113.902 156.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.85 -3.32 9.25 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.065 1.746 . . . . 41.14 112.92 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -119.23 6.42 11.22 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.599 1.96 . . . . 73.1 111.9 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.251 1.137 0 N-CA-C 106.543 -1.651 . . . . 74.42 106.543 171.305 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 108.56 -0.904 . . . . 53.22 108.56 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.79 18.43 6.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.352 0.978 . . . . 74.13 112.51 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.409 HG12 ' CB ' ' A' ' 50' ' ' GLU . 7.2 mt -122.03 138.51 52.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 105.884 -1.895 . . . . 73.32 105.884 -176.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.28 3.7 t -120.94 91.27 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 104.666 -2.346 . . . . 72.02 104.666 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.59 125.91 30.21 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.624 -1.621 . . . . 72.34 106.624 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mt -115.45 117.21 29.74 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.408 -1.33 . . . . 75.41 107.408 -167.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -102.41 161.72 13.48 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 119.056 0.844 . . . . 73.12 110.596 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 mtm 74.72 53.38 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.027 1.731 . . . . 73.3 108.657 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.541 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 1.6 tp -103.01 145.16 30.06 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 124.514 1.126 . . . . 75.01 111.236 -175.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 12' ' ' ALA . 50.9 Cg_endo -71.38 173.75 11.9 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 124.234 3.289 . . . . 71.43 112.406 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -84.97 -14.34 47.85 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.616 0.766 . . . . 74.21 110.981 166.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 10' ' ' PRO . . . -107.81 0.36 22.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.188 1.181 . . . . 74.52 114.188 -170.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.83 175.33 7.38 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.019 1.281 . . . . 72.51 109.398 169.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.1 p -144.5 165.35 28.22 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 120.778 -1.201 . . . . 55.42 110.462 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -46.51 -44.95 18.13 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.636 1.174 . . . . 74.2 111.258 174.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -15.95 58.42 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.083 -0.962 . . . . 63.1 111.903 -170.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -68.39 -50.56 52.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.896 0.879 . . . . 71.54 108.95 174.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.494 ' CD1' HD23 ' A' ' 34' ' ' LEU . 82.1 mt -57.58 -48.31 83.44 Favored 'Isoleucine or valine' 0 C--N 1.342 0.239 0 O-C-N 121.637 -0.664 . . . . 72.13 109.416 172.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -61.36 -35.03 76.32 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.698 -0.668 . . . . 71.53 110.01 -175.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.65 -25.18 57.05 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-O 118.753 -1.026 . . . . 54.13 113.579 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -46.79 82.32 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 120.188 1.994 . . . . 75.52 107.122 170.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 26.6 mt -61.77 -45.83 92.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.408 1.083 . . . . 73.11 111.476 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -56.27 -31.9 64.04 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 122.607 0.363 . . . . 75.32 110.694 -172.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 t -66.65 -30.09 70.27 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 126.245 1.818 . . . . 70.22 111.429 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.9 -11.69 32.82 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.363 -0.836 . . . . 73.34 112.586 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.46 -25.14 14.07 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.688 1.137 . . . . 54.41 110.541 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.46 170.06 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 126.531 1.932 . . . . 73.1 110.653 174.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -125.49 -31.37 3.01 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.653 -1.165 . . . . 74.53 113.991 -176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 61.56 122.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.815 1.646 . . . . 75.1 108.572 -143.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -87.12 -51.69 5.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 107.336 -1.357 . . . . 75.3 107.336 165.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.78 159.81 28.69 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.285 -1.376 . . . . 75.44 107.285 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.277 1.6 p -162.86 148.17 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 122.129 0.966 . . . . 63.43 111.883 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . 0.381 1.4 ptt-85 -129.84 67.9 1.45 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 130.823 3.649 . . . . 71.05 112.734 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.494 HD23 ' CD1' ' A' ' 18' ' ' ILE . 1.3 tm? -76.39 163.21 27.19 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.457 0.703 . . . . 75.3 109.638 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.476 ' H ' HD22 ' A' ' 34' ' ' LEU . 20.6 mtp -59.4 14.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 129.724 3.209 . . . . 72.05 116.046 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -139.94 132.76 29.15 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 126.045 1.738 . . . . 75.42 108.332 171.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -162.58 -47.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.152 0.981 . . . . 75.22 113.326 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.08 7.35 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 118.347 2.721 . . . . 75.44 118.347 -169.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -121.41 -16.89 7.74 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 127.889 2.476 . . . . 74.42 111.634 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.8 t -126.7 -31.54 2.69 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.159 1.345 . . . . 61.42 113.539 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.88 21.25 12.37 Favored Glycine 0 N--CA 1.473 1.134 0 CA-C-N 119.057 0.844 . . . . 73.11 112.875 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -67.8 118.92 11.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.813 1.245 . . . . 75.04 108.377 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p 174.76 141.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 129.667 3.187 . . . . 61.32 106.523 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 173.86 0.37 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.441 2.696 . . . . 71.12 115.026 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.74 61.26 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-N 121.994 2.179 . . . . 71.12 112.418 -174.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -145.04 170.46 16.14 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 125.347 1.459 . . . . 73.42 108.802 169.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.541 ' HB2' ' CD2' ' A' ' 9' ' ' LEU . . . -128.21 166.78 17.88 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 129.021 2.928 . . . . 73.41 109.247 -176.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -146.96 100.14 3.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.23 -2.137 . . . . 72.03 105.23 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.6 p -89.05 149.01 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-O 117.203 -1.379 . . . . 52.53 107.6 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CB ' HG12 ' A' ' 3' ' ' ILE 0.268 10.6 pt-20 -138.12 158.14 44.91 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 123.915 1.817 . . . . 71.13 113.14 164.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -128.26 148.23 50.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 112.788 -2.006 . . . . 73.23 108.204 -152.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.0 t -82.26 -23.45 35.28 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.182 -0.437 . . . . 74.34 111.59 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -100.1 -20.01 16.22 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.129 1.159 . . . . 73.21 114.129 -161.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.7 tt 65.23 -32.49 0.15 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.252 2.221 . . . . 65.23 114.579 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.38 -42.93 71.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 127.597 2.359 . . . . 62.22 110.688 171.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -69.62 -21.7 63.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.515 -0.741 . . . . 63.34 111.212 -170.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.3 -45.47 87.92 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.155 -1.054 . . . . 64.2 108.155 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.3 m -59.63 -46.79 87.95 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 124.548 1.139 . . . . 70.31 110.342 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -62.94 -43.11 99.7 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.075 -0.391 . . . . 65.32 110.317 -168.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -64.48 -37.12 86.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 121.143 -0.223 . . . . 73.11 111.375 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 mmm -61.59 -62.46 1.8 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.289 1.035 . . . . 74.23 110.937 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -59.01 -41.38 87.57 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 123.493 0.717 . . . . 53.22 111.02 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.05 -30.26 70.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.895 0.878 . . . . 64.1 111.738 -176.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -89.73 -2.62 58.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 118.841 -0.6 . . . . 52.44 111.44 173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 58.69 39.38 24.48 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.548 -1.278 . . . . 70.34 107.548 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m170 57.24 16.0 2.83 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.224 1.81 . . . . 70.01 114.291 -176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.42 104.2 4.91 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.603 1.092 . . . . 70.0 109.651 -172.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.6 mt -85.69 174.18 9.57 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.943 -0.762 . . . . 74.54 108.943 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -142.62 100.63 3.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.824 -0.436 . . . . 64.44 109.824 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -123.98 133.92 67.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 106.284 -1.747 . . . . 75.3 106.284 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.1 mp 48.43 35.54 5.98 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.344 1.858 . . . . 74.3 110.726 -174.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.66 -10.64 12.19 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.287 -1.285 . . . . 75.3 114.636 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -73.31 133.32 43.84 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.552 2.176 . . . . 53.44 108.073 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.7 ttmt -75.97 107.82 8.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 105.276 -2.12 . . . . 73.42 105.276 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.0 t -80.14 163.54 3.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.997 -1.483 . . . . 74.1 106.997 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -118.87 152.2 36.72 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.568 0.747 . . . . 63.4 109.928 162.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.8 ptm -130.97 148.8 52.77 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.602 0.761 . . . . 71.41 112.404 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -147.54 150.41 34.46 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.814 1.246 . . . . 74.44 110.101 -160.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -85.88 73.54 10.32 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.959 2.104 . . . . 73.42 109.57 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.98 84.21 1.25 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.005 1.322 . . . . 70.34 108.469 158.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.82 156.96 91.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 O-C-N 120.686 -1.259 . . . . 71.21 112.47 -175.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -68.57 -46.44 1.89 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.744 1.629 . . . . 61.24 113.966 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.8 ptpt -160.6 154.24 18.87 Favored Pre-proline 0 C--O 1.238 0.478 0 N-CA-C 105.342 -2.096 . . . . 72.11 105.342 165.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -61.56 101.29 0.2 Allowed 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.056 2.504 . . . . 74.34 110.134 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -100.24 17.48 21.23 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.029 1.332 . . . . 72.1 111.363 -177.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.589 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.4 mp -72.68 166.4 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 125.301 1.441 . . . . 63.32 107.715 176.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -58.24 -176.25 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.861 1.264 . . . . 71.44 109.846 165.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.17 112.63 0.43 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.784 2.434 . . . . 74.42 109.097 177.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -68.38 -9.17 46.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.326 0.65 . . . . 64.13 112.417 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 32.4 p-90 -117.03 5.9 12.87 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 127.187 2.195 . . . . 72.3 110.823 -170.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.253 1.285 0 N-CA-C 104.608 -2.367 . . . . 74.31 104.608 162.737 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 109.014 -0.736 . . . . 74.33 109.014 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -132.19 -4.76 3.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.871 1.214 . . . . 71.54 112.001 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 78.2 mt -99.72 137.39 27.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 N-CA-C 106.931 -1.507 . . . . 74.41 106.931 167.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.31 113.92 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.819 -2.289 . . . . 72.43 104.819 165.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.45 ' C ' HD22 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -97.36 162.97 13.08 Favored 'General case' 0 CA--C 1.524 -0.048 0 CA-C-N 118.82 0.736 . . . . 72.4 109.861 166.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.461 HD21 ' CZ3' ' A' ' 60' ' ' TRP . 2.7 mm? -129.49 90.04 2.94 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.903 1.281 . . . . 75.12 108.548 -168.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.2 mtm180 -72.57 163.2 28.42 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 121.379 -0.826 . . . . 60.54 110.182 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.6 mtm 69.67 20.04 7.09 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.523 1.929 . . . . 75.24 113.02 177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tp -63.16 144.4 97.38 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.345 1.058 . . . . 74.41 110.781 175.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.06 169.8 19.67 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.555 2.837 . . . . 72.32 110.771 176.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -70.45 -34.59 72.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 118.804 -0.617 . . . . 72.11 111.221 174.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.3 -30.9 57.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.018 -0.991 . . . . 71.53 113.049 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 132.44 53.94 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 124.031 0.832 . . . . 60.43 110.448 -162.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 22.5 p -93.32 163.43 13.61 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.494 1.518 . . . . 73.21 109.911 176.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.52 -34.76 59.34 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.305 173.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -39.81 41.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.124 0.97 . . . . 72.14 112.417 -176.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.86 -26.22 58.11 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.699 0.681 . . . . 75.21 111.455 174.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.92 -34.3 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 124.083 0.953 . . . . 55.24 109.46 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.524 ' HA ' HD12 ' A' ' 22' ' ' LEU . 71.5 mtt180 -57.59 -33.05 67.78 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.361 0.982 . . . . 74.42 110.126 173.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.12 -36.32 91.71 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-O 118.02 -1.434 . . . . 73.41 111.902 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -71.73 -27.19 62.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.739 1.769 . . . . 63.41 110.634 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' ' 29' ' ' ALA . 8.4 mt -72.28 -59.12 2.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.26 -1.015 . . . . 72.53 108.26 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -63.77 -14.82 55.97 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 121.317 -0.864 . . . . 55.24 112.109 -178.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t -55.44 -37.53 67.84 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 116.484 -1.722 . . . . 64.32 111.115 167.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' CD2' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -110.0 -9.75 14.74 Favored 'General case' 0 C--N 1.353 0.741 0 CA-C-N 122.305 2.321 . . . . 63.43 108.817 -162.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 115.7 33.26 1.59 Allowed Glycine 0 C--N 1.338 0.665 0 N-CA-C 110.779 -0.929 . . . . 75.52 110.779 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' CG2' ' CD2' ' A' ' 25' ' ' HIS . 1.4 m -134.42 118.68 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.954 1.302 . . . . 75.24 110.72 -176.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.506 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 3.9 pm0 -73.48 -11.79 60.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.508 1.923 . . . . 72.31 114.522 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.689 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.6 94.44 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.812 2.445 . . . . 71.32 115.227 -165.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -65.55 -32.88 74.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.172 -0.918 . . . . 74.41 112.79 -175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -142.66 147.57 35.97 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.126 -1.065 . . . . 73.4 108.126 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.9 t -156.16 148.06 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 125.251 1.421 . . . . 71.11 108.017 -174.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -144.62 92.06 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.691 1.132 . . . . 75.21 112.37 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -107.65 -172.47 2.08 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 124.413 1.085 . . . . 75.42 113.333 -175.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.716 ' H ' HD22 ' A' ' 34' ' ' LEU . 70.6 mtp -67.7 -9.98 48.4 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.22 1.933 . . . . 72.3 116.22 -162.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -44.07 -58.03 3.05 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.965 2.106 . . . . 72.14 111.053 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.495 HD22 ' CB ' ' A' ' 40' ' ' SER . 1.0 OUTLIER -74.66 70.72 1.86 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 126.422 1.889 . . . . 55.01 113.525 -163.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 -0.07 5.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 120.368 -1.458 . . . . 75.13 114.107 -166.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 m -104.34 -45.4 4.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.875 0.762 . . . . 75.41 109.78 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.495 ' CB ' HD22 ' A' ' 37' ' ' ASN . 48.2 t -58.73 -33.36 70.14 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.432 1.014 . . . . 62.32 110.885 174.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.62 51.99 3.68 Favored Glycine 0 C--N 1.335 0.496 0 N-CA-C 107.903 -2.079 . . . . 71.31 107.903 176.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -90.29 22.61 3.26 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.097 -1.075 . . . . 55.1 108.097 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 p -136.02 94.92 3.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.912 2.085 . . . . 75.22 111.036 -163.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.66 -71.36 0.59 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 127.441 2.296 . . . . 71.12 108.242 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.86 32.19 0.06 OUTLIER Glycine 0 CA--C 1.524 0.641 0 C-N-CA 126.47 1.986 . . . . 74.32 108.228 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -153.36 165.39 35.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.771 1.628 . . . . 54.44 108.991 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.71 154.22 50.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.752 -1.573 . . . . 51.42 106.752 166.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -92.98 151.02 20.15 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.075 -1.454 . . . . 72.12 107.075 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.15 129.16 62.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.925 -2.25 . . . . 73.54 104.925 165.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.13 124.01 51.04 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.621 1.568 . . . . 73.32 108.127 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -91.53 -179.01 5.25 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.239 0.542 . . . . 64.43 110.092 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.3 m -106.84 -5.1 18.59 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.712 1.205 . . . . 41.23 112.317 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.9 m-70 -144.51 126.31 15.26 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 107.493 -1.299 . . . . 73.5 107.493 -168.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.78 -9.41 1.76 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 115.078 1.51 . . . . 52.12 115.078 -176.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -22.25 16.26 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.735 1.214 . . . . 73.14 112.705 177.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.04 -32.26 64.96 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 123.321 0.648 . . . . 64.21 110.255 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.41 -50.09 74.26 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.11 -1.07 . . . . 73.33 108.11 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -42.58 90.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.971 1.309 . . . . 61.24 110.612 175.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.3 ttt85 -56.37 -48.69 76.32 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.756 -1.202 . . . . 55.23 107.756 -176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.471 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 4.7 t90 -63.35 -51.03 67.61 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 123.855 0.722 . . . . 74.15 111.291 177.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 4.5 mmm -52.75 -62.63 1.52 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.253 1.021 . . . . 64.31 110.518 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.44 -33.2 66.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.909 0.385 . . . . 73.13 110.391 -168.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.81 -7.03 36.38 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.849 -0.532 . . . . 75.21 111.869 176.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -124.17 14.57 9.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 124.387 1.075 . . . . 75.32 110.9 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 60.79 19.28 9.46 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.583 1.553 . . . . 71.31 111.252 171.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.9 m170 70.17 8.27 6.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.535 2.334 . . . . 61.42 115.136 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -148.69 102.49 3.3 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 121.152 1.796 . . . . 74.32 112.615 -177.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 44.5 mt -81.73 179.7 7.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.217 1.807 . . . . 72.54 110.914 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -146.86 85.98 1.64 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.58 -0.7 . . . . 74.44 111.594 -177.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -106.68 130.2 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.183 -1.043 . . . . 74.13 108.183 -170.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mp 54.37 21.79 3.41 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.431 1.493 . . . . 73.32 111.647 -171.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.52 3.01 82.2 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.608 -1.107 . . . . 62.55 113.91 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.14 142.72 43.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 119.222 1.511 . . . . 74.55 107.158 167.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 128.44 35.65 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 106.057 -1.831 . . . . 72.41 106.057 166.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.67 146.4 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 107.301 -1.37 . . . . 74.15 107.301 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -126.95 125.7 41.97 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.637 0.775 . . . . 74.23 110.416 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.99 149.25 23.36 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.728 0.695 . . . . 61.54 112.067 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -141.26 132.8 26.98 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 127.316 2.247 . . . . 72.13 109.557 -172.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -67.63 121.64 16.33 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.586 -0.894 . . . . 71.13 108.586 158.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -129.01 54.53 1.79 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 106.984 -1.487 . . . . 64.22 106.984 176.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.43 154.96 61.29 Favored Pre-proline 0 C--O 1.237 0.431 0 N-CA-C 111.721 0.267 . . . . 72.42 111.721 -167.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -73.09 -18.88 23.51 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.763 0.976 . . . . 75.54 114.212 -166.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.4 pttt 59.11 166.17 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 128.345 2.658 . . . . 71.4 113.364 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.62 105.67 0.95 Allowed 'Trans proline' 0 N--CA 1.447 -1.227 0 N-CA-C 106.889 -2.004 . . . . 41.41 106.889 161.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -118.17 24.04 11.22 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 122.19 0.995 . . . . 75.34 109.788 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.777 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.9 OUTLIER -74.87 154.0 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 105.835 -1.913 . . . . 75.04 105.835 166.225 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -74.06 -5.88 44.21 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.827 1.047 . . . . 71.23 113.827 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -136.96 113.13 9.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 107.537 -1.282 . . . . 64.2 107.537 -171.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 1.64 41.41 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.692 -1.594 . . . . 71.42 111.99 -176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -129.59 0.24 4.96 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.849 2.06 . . . . 73.1 112.208 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--O 1.254 1.316 0 C-N-CA 123.9 0.88 . . . . 63.11 108.882 170.736 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 109.395 -0.594 . . . . 72.33 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -144.9 26.72 1.35 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.669 1.987 . . . . 73.44 108.636 -176.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 54.5 mt -139.46 139.74 38.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 N-CA-C 104.666 -2.346 . . . . 63.14 104.666 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 t -128.35 120.79 53.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.723 -0.843 . . . . 60.15 108.723 -173.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.2 ttt -93.29 112.76 24.78 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.254 1.821 . . . . 75.42 107.141 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -105.06 80.82 1.66 Allowed 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 107.344 -1.354 . . . . 71.41 107.344 -173.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.16 -5.01 50.42 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.911 1.448 . . . . 73.41 114.911 -157.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 mtm -133.32 69.37 1.48 Allowed 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 125.703 1.601 . . . . 73.35 107.668 -174.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tp -104.74 145.8 31.4 Favored Pre-proline 0 C--O 1.235 0.331 0 C-N-CA 123.574 0.75 . . . . 51.04 110.512 175.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -71.31 158.86 53.41 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.404 2.069 . . . . 73.51 113.315 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -68.93 -8.18 42.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.779 1.632 . . . . 64.11 113.15 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.57 -23.25 14.73 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 117.383 -1.294 . . . . 71.22 113.499 172.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.72 135.72 56.8 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.694 1.133 . . . . 74.12 110.781 -167.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.6 p -97.89 167.35 10.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.366 0.603 . . . . 75.43 110.588 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.83 -34.01 72.51 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 120.133 -0.627 . . . . 63.55 110.158 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.78 -37.49 82.05 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 71.55 110.693 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.48 -38.02 85.75 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.655 1.182 . . . . 73.33 110.954 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 22' ' ' LEU . 24.6 mt -69.12 -52.77 30.32 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 N-CA-C 107.017 -1.475 . . . . 53.04 107.017 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -57.26 -37.66 72.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.012 1.325 . . . . 74.33 109.746 -175.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.98 -49.63 66.18 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 125.078 1.323 . . . . 64.11 111.9 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -48.43 80.16 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 118.456 1.128 . . . . 63.54 108.659 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.843 HD13 ' HB2' ' A' ' 29' ' ' ALA . 27.4 mt -57.03 -56.39 22.35 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.068 -0.716 . . . . 71.32 109.068 -177.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -62.86 -30.37 71.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 112.168 0.433 . . . . 61.55 112.168 -175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -62.44 -43.57 98.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.538 -0.744 . . . . 63.45 111.339 174.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.424 ' CE1' HD21 ' A' ' 64' ' ' ASN . 91.5 m-70 -76.12 -9.57 58.73 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.296 0.953 . . . . 75.13 112.971 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.11 24.08 12.11 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 119.516 1.053 . . . . 54.23 112.026 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 51' ' ' PHE . 91.8 t -111.22 133.9 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 125.463 1.505 . . . . 71.52 108.371 -174.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.554 ' H ' ' NE2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -75.48 -46.1 34.42 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.532 0.733 . . . . 74.54 112.393 -171.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.843 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 63.53 110.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.237 1.415 . . . . 75.31 109.937 -157.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -69.02 -42.57 76.24 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.21 -0.931 . . . . 74.41 109.909 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -156.18 161.74 40.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 105.694 -1.965 . . . . 73.23 105.694 -168.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 p -163.87 154.8 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 O-C-N 121.329 -0.857 . . . . 61.32 110.008 174.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -141.68 99.77 3.62 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.889 2.076 . . . . 73.14 107.056 -173.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.702 HD22 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -129.71 -154.48 0.64 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.832 1.653 . . . . 54.05 108.261 175.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.702 ' H ' HD22 ' A' ' 34' ' ' LEU . 5.7 mtp -68.94 69.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 129.002 2.921 . . . . 74.54 114.05 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -143.63 -35.12 0.39 Allowed 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 118.545 -0.741 . . . . 74.34 111.764 -164.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -77.12 -45.69 26.05 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 119.834 1.197 . . . . 73.34 108.586 -172.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 47.06 -7.74 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 1 C-N-CA 132.296 4.238 . . . . 74.11 115.962 -154.095 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.78 -17.18 18.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 118.248 -0.882 . . . . 75.55 112.897 -165.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.5 t -131.27 -26.74 2.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.73 1.15 . . . . 52.03 113.311 -162.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.73 -2.71 2.22 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 115.732 1.053 . . . . 63.54 115.732 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -75.42 11.03 1.36 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.228 1.514 . . . . 63.54 114.151 -160.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HA ' ' A' ' 35' ' ' MET . 3.6 p -131.88 105.41 7.43 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 125.389 1.476 . . . . 73.32 111.338 -173.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -153.52 9.69 0.41 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.351 1.241 . . . . 64.15 114.351 175.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.05 25.44 8.99 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 124.927 1.251 . . . . 60.15 111.845 -175.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -157.03 175.55 13.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.526 1.531 . . . . 72.45 110.591 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.485 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -135.51 165.2 26.06 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.843 2.057 . . . . 62.13 110.517 -177.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -125.93 106.77 9.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 106.682 -1.599 . . . . 74.13 106.682 163.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.0 p -89.65 149.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 107.962 -1.125 . . . . 44.23 107.962 167.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -111.9 148.06 34.49 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 120.037 1.29 . . . . 75.35 108.508 159.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.614 ' CE2' HG11 ' A' ' 27' ' ' VAL . 5.5 m-85 -109.43 151.02 27.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.159 1.783 . . . . 64.23 107.948 176.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.1 m -74.58 -24.43 58.9 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 119.126 -0.464 . . . . 74.41 111.008 173.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.3 m-70 -136.41 145.43 45.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.013 -0.736 . . . . 62.13 109.013 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.4 mt -61.68 -54.26 45.04 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.711 0.804 . . . . 73.33 109.344 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -65.9 -22.02 66.48 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.858 0.688 . . . . 74.41 112.858 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -72.46 -30.99 65.06 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.227 0.611 . . . . 64.34 109.756 176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.45 75.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.096 -1.446 . . . . 72.43 107.096 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.79 -43.1 90.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.615 0.766 . . . . 61.54 110.596 175.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -57.63 -34.67 69.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.775 -0.631 . . . . 75.23 109.784 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -76.57 -43.83 37.18 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 119.785 1.175 . . . . 62.54 111.327 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 94.4 mmm -50.61 -68.14 0.2 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.978 1.311 . . . . 75.23 110.324 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -74.47 -30.69 61.96 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 119.293 -0.384 . . . . 64.33 111.806 -163.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.91 -51.31 68.07 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.466 -0.568 . . . . 35.4 109.466 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.424 HD21 ' CE1' ' A' ' 25' ' ' HIS . 70.2 m-80 -87.48 5.96 36.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.994 0.809 . . . . 72.33 111.355 -176.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 55.68 41.3 30.61 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.965 0.888 . . . . 72.12 109.12 176.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 22.8 m170 60.54 9.71 2.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.714 2.406 . . . . 73.11 114.805 -176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -134.22 106.09 6.97 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 119.977 1.262 . . . . 75.53 111.342 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.88 174.57 10.81 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.687 0.795 . . . . 75.22 109.859 174.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -141.51 99.43 3.56 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.052 0.541 . . . . 75.45 110.469 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.432 HD12 HG21 ' A' ' 75' ' ' VAL . 4.9 mt -131.01 123.17 53.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 106.392 -1.707 . . . . 74.22 106.392 -166.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.0 mp 51.51 31.93 8.19 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.552 1.541 . . . . 73.34 109.765 -165.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.9 -7.64 7.17 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.396 1.474 . . . . 71.25 115.592 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -69.44 145.86 52.46 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 119.805 1.802 . . . . 74.22 108.537 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -76.21 111.38 11.58 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.088 -1.449 . . . . 74.21 107.088 166.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.432 HG21 HD12 ' A' ' 70' ' ' ILE . 36.2 t -89.42 159.5 2.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 106.688 -1.597 . . . . 62.21 106.688 168.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.1 p -121.36 128.58 52.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.177 -1.045 . . . . 63.55 108.177 168.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.62 150.72 20.84 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.803 0.811 . . . . 73.43 110.588 172.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -144.61 140.5 28.77 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.599 2.36 . . . . 71.44 105.862 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -66.62 111.22 3.53 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.472 -0.936 . . . . 72.53 108.472 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.32 72.3 10.36 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 106.127 -1.805 . . . . 72.15 106.127 163.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.26 144.61 69.91 Favored Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 121.206 -0.934 . . . . 61.33 111.053 -171.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.69 -22.74 20.25 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.922 1.748 . . . . 54.05 112.982 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.272 11.2 ptpt 54.27 163.91 0.05 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 131.224 3.809 . . . . 71.34 114.451 -172.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.52 100.82 0.5 Allowed 'Trans proline' 0 N--CA 1.443 -1.452 0 N-CA-C 107.438 -1.793 . . . . 55.33 107.438 158.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.94 22.43 13.94 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.138 1.375 . . . . 73.13 108.312 173.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.597 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.9 mp -64.29 137.17 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 N-CA-C 104.34 -2.467 . . . . 64.45 104.34 160.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -72.02 -3.11 20.96 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.524 0.935 . . . . 74.23 113.524 -178.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -136.21 168.02 20.18 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.445 1.898 . . . . 62.12 109.33 175.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.81 -1.52 7.27 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.849 0.859 . . . . 75.15 112.581 -176.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -111.56 5.44 19.43 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.02 2.128 . . . . 73.25 111.381 171.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.249 1.034 0 C-N-CA 124.174 0.989 . . . . 75.44 109.909 172.792 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.9 t . . . . . 0 CA--C 1.514 -0.409 0 CA-C-O 122.323 1.059 . . . . 40.32 108.944 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -137.06 1.02 2.43 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 130.03 3.332 . . . . 74.33 108.135 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.47 134.62 50.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 125.5 1.52 . . . . 53.34 107.019 174.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 52.8 t -128.4 103.67 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 105.225 -2.139 . . . . 61.45 105.225 172.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 55.1 ttp -82.14 122.26 27.64 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.67 -1.604 . . . . 63.23 106.67 175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 30.2 mt -91.56 114.99 27.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.541 -1.281 . . . . 61.14 107.541 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -98.68 157.38 16.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 119.572 1.078 . . . . 75.42 109.705 173.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.1 mtm 73.07 28.15 1.94 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.398 1.479 . . . . 74.42 110.249 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 24.5 mt -70.73 144.28 90.73 Favored Pre-proline 0 C--O 1.234 0.261 0 N-CA-C 107.837 -1.172 . . . . 73.03 107.837 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.97 170.72 17.34 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.709 2.273 . . . . 55.44 110.748 176.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -68.35 -36.0 78.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.603 -0.726 . . . . 72.25 110.518 173.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.47 -24.24 59.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 117.985 -1.007 . . . . 41.31 113.304 -168.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.99 159.27 14.58 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.839 0.828 . . . . 73.31 111.673 -176.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -129.25 157.3 42.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.594 1.558 . . . . 75.11 108.016 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -58.21 -34.93 70.93 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 121.882 -0.511 . . . . 71.41 110.289 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -63.41 -26.21 68.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.021 1.329 . . . . 75.14 112.412 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.22 -55.07 15.58 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.774 -0.825 . . . . 62.31 108.774 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.9 mt -51.24 -49.2 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 125.804 1.641 . . . . 75.22 107.697 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HA ' ' CD2' ' A' ' 22' ' ' LEU . 7.4 mtt-85 -60.6 -22.75 64.09 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 120.017 1.28 . . . . 64.15 113.546 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.84 -14.79 62.39 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 116.084 1.194 . . . . 72.15 116.084 169.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.67 61.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 120.286 2.043 . . . . 62.15 108.272 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.565 HD12 ' CZ2' ' A' ' 60' ' ' TRP . 0.1 OUTLIER -81.09 -45.5 16.37 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 108.152 -1.055 . . . . 64.02 108.152 -163.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -56.75 -27.95 60.3 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.004 -1.453 . . . . 64.15 112.148 172.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -55.97 -55.25 35.03 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 120.139 1.336 . . . . 72.02 109.157 170.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.89 -5.27 40.07 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.53 1.132 . . . . 55.51 113.147 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.26 -5.62 71.45 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.619 -1.3 . . . . 71.03 113.222 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 t -75.5 169.92 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 125.72 1.608 . . . . 75.02 108.474 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.52 150.51 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.476 -1.305 . . . . 75.04 107.476 163.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.02 127.18 32.63 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 119.96 1.254 . . . . 72.42 107.653 149.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -59.05 2.37 Favored 'General case' 0 C--O 1.227 -0.13 0 N-CA-C 106.96 -1.496 . . . . 62.35 106.96 163.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -106.67 154.11 21.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.426 1.49 . . . . 75.13 108.249 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.5 t -141.75 161.96 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.212 1.005 . . . . 73.12 108.518 163.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -143.1 65.79 1.33 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.415 1.886 . . . . 74.35 109.234 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD13 ' H ' ' A' ' 35' ' ' MET . 0.1 OUTLIER -111.5 -153.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.352 -1.722 . . . . 74.12 106.352 166.023 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.569 ' H ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER 55.13 -176.49 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.236 1 C-N-CA 132.133 4.173 . . . . 75.43 110.222 -169.043 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.8 140.08 29.95 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 106.799 -1.556 . . . . 73.14 106.799 168.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -161.12 98.03 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.668 0.387 . . . . 64.43 111.35 170.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -11.5 40.96 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.894 1.442 . . . . 64.35 114.894 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -93.06 -13.63 28.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.497 1.119 . . . . 64.22 111.139 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.5 t -123.6 -42.04 2.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 120.363 1.438 . . . . 42.51 112.164 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 122.38 16.09 3.95 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 123.813 0.72 . . . . 72.13 113.303 172.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -85.71 173.72 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 117.96 0.88 . . . . 75.15 109.712 -173.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.0 p 75.33 88.45 0.09 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 130.807 3.643 . . . . 72.21 110.42 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -132.86 -0.48 3.43 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.547 -0.752 . . . . 74.21 112.118 -173.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.53 10.73 58.38 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.802 -1.186 . . . . 54.21 110.888 -161.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 17.6 p90 -135.12 164.3 27.98 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 125.757 1.623 . . . . 74.15 107.706 153.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.57 174.77 10.23 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 128.527 2.731 . . . . 72.24 107.185 170.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -124.17 155.08 39.12 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.083 -1.08 . . . . 75.21 108.083 171.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.9 t -124.18 125.17 70.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 103.461 -2.792 . . . . 61.12 103.461 160.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.38 117.64 31.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.432 -2.433 . . . . 64.32 104.432 163.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -82.38 -172.26 3.91 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.912 -0.403 . . . . 71.21 109.912 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -103.78 -27.79 12.03 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.807 0.443 . . . . 75.24 112.07 172.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -115.78 141.76 47.66 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.923 -1.14 . . . . 54.51 107.923 178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.2 -37.43 74.77 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.325 -0.991 . . . . 60.11 108.325 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -36.58 67.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.782 0.833 . . . . 74.43 112.645 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -61.37 -38.96 88.9 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.502 1.501 . . . . 74.45 108.929 -177.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.38 -53.21 38.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.695 -1.224 . . . . 53.35 107.695 -172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -46.53 88.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.587 0.755 . . . . 74.05 111.188 178.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -59.0 -43.76 91.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.365 -0.976 . . . . 74.42 108.365 -177.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.565 ' CZ2' HD12 ' A' ' 22' ' ' LEU . 2.4 t90 -58.92 -52.59 65.11 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.317 0.386 . . . . 74.33 111.454 176.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.4 mmm -55.93 -65.88 0.52 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.849 1.66 . . . . 74.43 110.983 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -62.63 -40.48 97.12 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.633 1.173 . . . . 74.25 109.608 -166.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.33 -25.45 59.55 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.312 1.045 . . . . 60.25 112.283 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -89.41 -0.12 57.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.52 0.6 . . . . 75.45 111.59 173.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 57.48 29.6 17.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.162 0.892 . . . . 62.44 108.919 -176.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 3.8 m170 65.02 17.85 11.25 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.513 1.925 . . . . 75.43 114.48 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.15 127.59 24.75 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.581 1.537 . . . . 63.03 110.305 175.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -105.04 172.3 6.86 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.346 1.458 . . . . 72.33 109.086 172.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -143.3 98.42 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.779 -1.193 . . . . 75.05 107.779 -177.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.2 mp -115.29 128.29 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 126.069 1.748 . . . . 71.45 106.867 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.3 mp 52.81 28.06 6.03 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.073 1.349 . . . . 73.03 110.902 -172.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.81 -6.82 16.98 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 118.329 -1.262 . . . . 71.42 114.011 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -73.48 143.42 46.62 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.91 1.855 . . . . 62.32 107.733 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -81.98 129.99 34.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.166 1.386 . . . . 63.41 108.186 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 t -128.3 137.84 56.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.265 -1.383 . . . . 72.12 107.265 -171.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.3 m -108.31 154.42 21.83 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.948 0.899 . . . . 53.55 110.06 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -127.36 141.63 51.65 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.865 1.266 . . . . 75.41 111.385 -174.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -144.93 143.34 30.5 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.679 1.192 . . . . 53.41 110.768 -171.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -74.8 82.81 2.13 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.026 1.331 . . . . 74.15 111.021 173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.65 60.04 5.86 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.808 1.243 . . . . 54.45 108.024 172.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.7 153.91 38.86 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.191 0.996 . . . . 75.3 111.565 -172.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -72.6 -40.72 1.94 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.887 1.725 . . . . 64.21 111.824 -164.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -159.34 146.12 12.61 Favored Pre-proline 0 N--CA 1.444 -0.734 0 C-N-CA 126.991 2.117 . . . . 71.4 106.567 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.99 105.34 0.66 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 C-N-CA 123.145 2.563 . . . . 74.03 107.617 175.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -118.84 43.84 2.45 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 126.281 1.832 . . . . 75.14 111.235 -167.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.619 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.5 mp -57.36 156.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 106.872 -1.529 . . . . 75.4 106.872 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -64.68 -154.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.564 1.145 . . . . 72.02 108.224 162.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.646 ' HB2' HD13 ' A' ' 91' ' ' LEU . 55.7 mm-40 -57.88 132.56 53.75 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 119.97 -1.706 . . . . 75.4 109.344 173.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.23 -3.08 5.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.856 -0.611 . . . . 74.21 110.704 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 48.1 p-90 -128.84 -5.51 5.1 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.421 1.088 . . . . 75.2 112.887 -174.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.646 HD13 ' HB2' ' A' ' 88' ' ' GLU 0.559 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 113.222 0.823 . . . . 74.43 113.222 168.721 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.451 ' HB2' ' CD2' ' A' ' 79' ' ' TYR . 1.5 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.774 -0.454 . . . . 70.15 109.774 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -126.07 12.57 7.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.392 2.277 . . . . 73.32 111.461 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 mt -109.62 120.98 61.83 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.229 -1.397 . . . . 73.21 107.229 175.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 t -103.22 117.82 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 105.261 -2.125 . . . . 52.34 105.261 169.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 19.4 tmm? -107.78 135.88 48.45 Favored 'General case' 0 CA--C 1.521 -0.172 0 N-CA-C 107.225 -1.398 . . . . 63.25 107.225 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -113.32 92.03 3.86 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.518 1.127 . . . . 71.44 108.18 -168.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -65.58 159.12 25.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.539 0.609 . . . . 61.3 109.877 174.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 mtm 72.99 26.33 2.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.204 1.402 . . . . 74.41 112.782 169.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tp -63.3 146.94 95.74 Favored Pre-proline 0 C--O 1.239 0.533 0 O-C-N 120.51 -1.369 . . . . 75.23 110.997 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.9 161.02 42.29 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 122.736 2.29 . . . . 75.0 110.908 167.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -75.9 -21.77 56.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.011 -1.449 . . . . 74.42 111.076 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.71 -25.79 32.62 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.936 1.087 . . . . 73.14 113.936 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 159.81 23.39 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.409 0.55 . . . . 73.24 111.064 -170.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -124.85 158.58 33.09 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.896 1.278 . . . . 73.03 109.479 -174.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -53.5 -40.05 65.07 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.08 0.552 . . . . 73.35 109.741 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -67.18 -38.14 84.9 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.903 0.481 . . . . 71.01 112.265 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.78 -47.01 86.2 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 122.523 1.154 . . . . 74.44 109.477 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 80.2 mt -70.8 -36.54 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 114.648 -1.16 . . . . 75.42 109.661 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 22' ' ' LEU . 15.8 mtt180 -53.0 -42.67 65.84 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.737 1.153 . . . . 74.32 110.744 176.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.03 -28.63 73.34 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 123.438 0.542 . . . . 73.21 112.979 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.19 2.87 6.44 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.744 1.272 . . . . 71.3 110.882 175.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 29' ' ' ALA . 1.8 mt -107.69 -45.8 3.95 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.673 1.578 . . . . 64.1 109.813 172.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -54.71 -38.8 67.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.32 0.509 . . . . 63.43 111.408 -175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.0 m -60.47 -14.7 20.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.435 1.642 . . . . 64.52 115.435 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.559 ' CE1' HD21 ' A' ' 64' ' ' ASN . 38.4 m-70 -112.79 -2.19 14.48 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.707 1.594 . . . . 73.14 111.423 176.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 96.59 24.15 14.46 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 124.181 0.896 . . . . 64.13 110.935 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.56 148.94 26.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 127.546 2.338 . . . . 73.03 111.366 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -100.84 -32.55 10.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.332 0.653 . . . . 74.23 112.092 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.508 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 55.46 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 125.358 1.463 . . . . 42.43 111.155 -152.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -37.1 67.17 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 119.397 -0.335 . . . . 55.42 110.2 -175.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -133.83 158.44 43.37 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 74.35 106.879 172.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 p -165.1 155.83 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.905 1.282 . . . . 60.41 109.228 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.42 81.27 1.74 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 129.027 2.931 . . . . 72.45 106.962 -175.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.765 HD13 ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -71.7 -154.17 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.616 1.198 . . . . 63.34 109.341 171.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.765 ' H ' HD13 ' A' ' 34' ' ' LEU . 1.4 mtm -94.9 -164.53 1.18 Allowed 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 127.421 2.288 . . . . 64.25 105.863 168.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtp85 68.84 -5.04 1.06 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 127.562 2.345 . . . . 73.33 116.736 167.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.73 -26.72 63.51 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.672 0.99 . . . . 75.23 113.672 -161.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER 47.29 -15.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 129.897 3.279 . . . . 51.21 118.459 -169.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.3 p -103.92 -6.25 21.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 120.028 1.285 . . . . 75.13 113.702 -167.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.1 p -146.92 -7.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.778 1.399 . . . . 74.14 114.778 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.42 27.91 37.97 Favored Glycine 0 C--N 1.337 0.618 0 O-C-N 120.25 -1.531 . . . . 41.23 110.861 168.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -60.27 -173.3 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.154 1.782 . . . . 73.23 109.427 164.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.404 ' HB2' ' SD ' ' A' ' 35' ' ' MET . 1.2 p 77.03 137.31 0.06 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.749 2.42 . . . . 72.22 111.926 -167.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -167.98 15.98 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.71 2.404 . . . . 75.21 111.988 165.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.51 8.5 87.11 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-N 120.132 1.333 . . . . 75.11 110.696 -169.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.21 169.37 17.56 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.558 1.143 . . . . 64.15 109.665 161.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.29 159.64 22.38 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 125.875 1.67 . . . . 53.41 106.721 167.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -126.21 130.38 50.84 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 105.077 -2.194 . . . . 73.11 105.077 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.6 t -136.31 119.96 23.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 105.936 -1.876 . . . . 51.12 105.936 -168.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.36 119.02 36.83 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.852 0.861 . . . . 74.35 110.627 -170.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.3 157.29 15.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.995 0.918 . . . . 61.31 109.979 -173.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.1 t -67.69 -36.44 80.66 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.452 -0.573 . . . . 63.35 109.452 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -121.08 128.26 52.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.95 0.9 . . . . 75.33 110.061 -164.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.9 tt -50.82 -48.12 59.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.953 1.301 . . . . 74.41 108.906 168.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.3 -35.36 62.54 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.779 1.631 . . . . 73.45 112.674 176.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -74.33 -26.51 60.2 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.624 1.102 . . . . 72.23 109.681 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.51 84.87 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.922 0.783 . . . . 70.13 109.66 -175.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -36.76 81.17 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.855 -0.157 . . . . 73.24 110.82 176.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ttm-85 -67.86 -21.41 65.17 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.877 -0.582 . . . . 73.24 112.031 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -83.71 -49.9 8.68 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 118.399 0.545 . . . . 75.01 110.638 167.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -58.61 7.11 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.265 0.626 . . . . 75.23 111.39 -171.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.88 -32.42 73.94 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 118.351 0.523 . . . . 73.01 109.87 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.16 -10.84 57.26 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.934 0.894 . . . . 74.5 113.352 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.559 HD21 ' CE1' ' A' ' 25' ' ' HIS . 65.8 m-80 -121.01 8.55 10.44 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.105 0.962 . . . . 74.44 110.778 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 52.95 34.4 16.76 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.726 0.81 . . . . 73.24 110.036 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 23.7 m170 66.66 10.94 7.84 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.789 2.036 . . . . 63.3 114.885 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.66 132.15 28.63 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 121.285 1.857 . . . . 75.1 111.204 176.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.3 mt -110.29 177.83 4.58 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.337 1.855 . . . . 63.13 110.416 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -145.32 110.27 5.15 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.295 -1.002 . . . . 61.4 108.295 172.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.1 mp -120.07 126.65 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 107.856 -1.164 . . . . 75.2 107.856 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt 53.96 29.13 9.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.279 2.632 . . . . 60.2 111.711 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.61 -12.15 67.91 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.022 1.772 . . . . 74.3 113.356 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -79.48 145.41 33.26 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 118.765 1.282 . . . . 75.12 108.107 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 130.27 41.33 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.473 -1.24 . . . . 64.41 107.756 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.85 149.31 32.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.206 -1.405 . . . . 53.21 107.206 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -134.0 123.14 24.08 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 121.025 -1.047 . . . . 74.34 109.538 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.58 150.89 22.21 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.121 0.486 . . . . 71.01 111.143 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -143.93 143.79 31.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.356 1.862 . . . . 71.25 108.289 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.451 ' CD2' ' HB2' ' A' ' 1' ' ' SER . 2.8 m-30 -67.57 116.9 8.81 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.521 -1.659 . . . . 72.23 106.521 162.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -128.99 52.26 1.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.689 -1.226 . . . . 74.41 107.689 -172.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.31 154.41 8.35 Favored Pre-proline 0 C--O 1.233 0.222 0 C-N-CA 123.9 0.88 . . . . 74.43 112.232 -165.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -69.93 -28.66 24.16 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 120.044 0.496 . . . . 75.32 113.123 -172.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HB2' ' HD2' ' A' ' 84' ' ' PRO 0.266 12.7 ptpt 54.79 164.47 0.05 OUTLIER Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 131.32 3.848 . . . . 73.24 113.334 -175.475 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 75.9 Cg_endo -67.76 106.03 1.22 Allowed 'Trans proline' 0 N--CA 1.443 -1.491 0 N-CA-C 106.987 -1.966 . . . . 61.33 106.987 164.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -105.37 14.27 29.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.021 1.329 . . . . 75.23 111.414 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 3.7 mp -67.28 147.45 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 122.297 1.046 . . . . 64.04 108.531 -169.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -5.07 26.88 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.745 1.017 . . . . 75.13 113.745 172.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.434 ' H ' HG22 ' A' ' 86' ' ' ILE . 9.9 mt-10 -134.41 90.98 2.73 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 129.665 3.186 . . . . 63.14 104.758 -174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.93 -10.21 31.79 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.726 -0.608 . . . . 75.44 112.165 -178.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -123.32 6.44 9.06 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.69 1.996 . . . . 73.03 112.662 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.246 0.892 0 N-CA-C 106.839 -1.541 . . . . 73.31 106.839 169.86 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.466 0.335 0 N-CA-C 108.076 -1.083 . . . . 72.32 108.076 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -125.22 9.21 7.95 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 118.573 -0.727 . . . . 62.24 111.412 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.9 mt -114.55 140.7 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 108.102 -1.073 . . . . 64.41 108.102 172.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.682 HG13 ' HB ' ' A' ' 49' ' ' VAL 0.343 0.6 OUTLIER -125.44 98.62 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.668 1 C-N-CA 133.181 4.593 . . . . 74.1 115.764 172.695 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 14.6 ttp -77.8 107.47 10.33 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.58 -0.896 . . . . 50.14 108.58 167.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.615 HD11 ' HH2' ' A' ' 60' ' ' TRP . 16.4 mt -86.92 104.15 15.98 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.846 -1.909 . . . . 72.0 105.846 173.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -87.27 165.4 15.69 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.111 0.869 . . . . 71.34 110.123 172.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.3 mtm 75.67 38.7 0.36 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 74.21 112.677 172.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 28.9 mt -97.83 144.65 28.37 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 113.944 1.09 . . . . 62.12 113.944 -178.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 29.8 Cg_endo -71.17 148.22 55.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.538 2.825 . . . . 62.35 113.305 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -29.29 59.56 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.083 1.753 . . . . 72.44 112.675 177.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -86.4 -25.13 25.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 117.739 -1.124 . . . . 70.15 112.739 -170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.5 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -50.01 156.58 0.74 Allowed 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.817 1.647 . . . . 45.55 112.57 -170.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 p -120.88 165.99 14.42 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-O 121.619 0.723 . . . . 71.13 111.777 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -51.67 -51.3 56.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.276 1.03 . . . . 65.43 109.947 170.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -57.62 -41.26 80.98 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.196 2.198 . . . . 73.02 110.306 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.47 -39.69 67.72 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.755 1.222 . . . . 45.55 111.263 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 mt -81.25 -41.77 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 108.597 -0.89 . . . . 64.24 108.597 178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.683 ' HA ' HD12 ' A' ' 22' ' ' LEU . 57.7 mtt-85 -55.94 -37.75 69.39 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 117.29 -1.338 . . . . 50.33 111.055 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.78 -44.52 95.82 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 118.953 0.797 . . . . 74.43 112.758 170.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -48.62 80.08 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 118.646 1.223 . . . . 71.13 108.785 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.746 HD13 ' CB ' ' A' ' 29' ' ' ALA . 6.8 mt -58.41 -45.75 87.79 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.735 -0.603 . . . . 71.23 109.809 -178.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -58.42 -37.41 75.29 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 118.177 -0.916 . . . . 62.45 112.237 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -41.71 79.64 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.274 0.943 . . . . 53.22 110.207 -177.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -73.94 -22.17 59.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.454 -0.779 . . . . 54.51 112.767 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.14 35.6 4.44 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.34 -1.104 . . . . 73.14 110.34 -173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.7 t -117.38 128.38 74.68 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 CA-C-N 119.065 1.432 . . . . 44.44 111.313 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -68.41 -24.45 64.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.536 1.534 . . . . 74.23 112.832 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.746 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.49 94.6 0.01 OUTLIER 'General case' 0 C--N 1.343 0.308 0 C-N-CA 129.495 3.118 . . . . 50.41 112.892 -164.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -49.63 77.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 119.3 -0.381 . . . . 73.3 110.376 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -133.44 141.07 47.66 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 106.429 -1.693 . . . . 70.33 106.429 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 m -145.51 150.23 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 109.61 -0.515 . . . . 72.41 109.61 178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -131.8 72.66 1.5 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.671 -0.643 . . . . 62.03 112.027 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 35' ' ' MET . 0.2 OUTLIER -77.29 -174.48 3.28 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 118.548 0.613 . . . . 72.22 110.813 -179.084 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.763 ' H ' HD13 ' A' ' 34' ' ' LEU . 3.0 ttp -88.4 -0.87 57.66 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.823 2.049 . . . . 74.14 112.269 -174.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mtp85 -119.26 113.15 20.41 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 104.959 -2.237 . . . . 74.01 104.959 171.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -166.45 87.12 0.33 Allowed 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.97 0.908 . . . . 70.41 110.947 175.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -28.33 23.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.572 0.952 . . . . 74.2 113.572 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -89.53 2.99 53.88 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.473 0.916 . . . . 74.12 113.473 -174.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.9 t -152.64 -14.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.658 1.572 . . . . 44.43 112.446 -176.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.68 77.54 Favored Glycine 0 C--N 1.342 0.914 0 O-C-N 119.722 -1.861 . . . . 73.1 110.86 170.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -63.32 114.63 3.95 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 126.448 1.899 . . . . 71.04 108.149 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.8 t 178.49 145.15 0.13 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 128.803 2.841 . . . . 70.23 108.062 -177.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 174.88 -42.5 0.01 OUTLIER 'General case' 0 C--N 1.346 0.417 0 C-N-CA 127.658 2.383 . . . . 71.34 111.622 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 122.02 0.35 10.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.793 0.711 . . . . 62.45 111.715 -165.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.13 169.99 9.72 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.01 0.924 . . . . 52.32 109.467 156.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -145.76 161.5 39.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 125.998 1.719 . . . . 54.4 106.38 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -125.19 124.65 42.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 116.374 -1.774 . . . . 71.43 108.317 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.682 ' HB ' HG13 ' A' ' 4' ' ' VAL . 21.6 t -97.51 133.5 39.07 Favored 'Isoleucine or valine' 0 C--N 1.348 0.503 0 CA-C-N 122.124 2.238 . . . . 54.11 106.981 168.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.08 133.38 52.46 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.57 1.548 . . . . 73.23 108.141 168.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -109.25 150.42 27.98 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.427 -0.352 . . . . 73.0 111.914 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.2 t -66.64 -26.23 66.96 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 124.447 1.092 . . . . 61.2 110.596 -178.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.94 136.15 49.14 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.378 -1.341 . . . . 62.13 107.378 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.32 -32.98 68.99 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.447 -0.783 . . . . 71.43 111.792 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -33.49 72.77 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.062 1.745 . . . . 73.22 111.869 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.99 -35.79 81.53 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.265 -1.383 . . . . 72.03 107.265 -177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.86 79.42 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.702 -0.624 . . . . 64.1 109.872 -174.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -42.2 98.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 119.022 -0.513 . . . . 63.32 111.709 175.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.1 ttp85 -52.64 -45.55 66.72 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 108.327 -0.99 . . . . 72.1 108.327 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.615 ' HH2' HD11 ' A' ' 6' ' ' LEU . 7.5 t90 -71.39 -50.9 27.44 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 113.543 0.942 . . . . 70.41 113.543 178.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.5 mmm -59.76 -61.18 2.81 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.43 1.092 . . . . 71.1 110.738 -173.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -62.48 -33.82 75.61 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.707 -0.849 . . . . 73.43 108.707 -173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.18 -20.9 62.23 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.215 -0.928 . . . . 70.02 113.374 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -92.78 2.14 56.91 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.942 0.792 . . . . 52.14 111.623 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 54.19 35.8 23.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.333 0.969 . . . . 65.44 109.516 -175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 m170 58.68 13.17 2.5 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.33 . . . . 74.4 113.592 178.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 p -145.33 116.71 8.0 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-N 120.066 1.303 . . . . 63.24 111.757 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.26 177.47 5.2 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.767 1.227 . . . . 74.05 112.022 -177.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.66 96.81 2.05 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.39 -1.277 . . . . 72.03 111.79 -169.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.488 HG22 ' HG ' ' A' ' 71' ' ' LEU . 5.1 mp -122.4 137.31 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 C-N-CA 124.322 1.049 . . . . 63.34 108.541 -177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.488 ' HG ' HG22 ' A' ' 70' ' ' ILE . 28.8 mt 51.26 26.39 2.96 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.158 1.783 . . . . 71.24 111.689 -175.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.23 -8.42 67.65 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.309 1.433 . . . . 73.31 113.782 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 10' ' ' PRO . 9.0 mt-30 -82.11 138.81 34.69 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 120.496 2.148 . . . . 74.15 109.907 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.05 132.71 42.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.039 -1.097 . . . . 72.01 108.039 170.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.5 t -124.18 140.33 47.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 127.226 2.21 . . . . 54.12 106.499 -176.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 65.2 m -110.87 120.14 41.42 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 107.49 -1.3 . . . . 74.24 107.49 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.467 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -77.81 150.86 34.21 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.078 -0.342 . . . . 54.4 110.078 165.681 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -143.63 132.95 23.26 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.782 2.033 . . . . 60.3 106.795 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -66.21 92.11 0.18 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.506 0.594 . . . . 73.42 109.997 170.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 1.9 t -88.97 63.95 6.95 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.125 -1.065 . . . . 71.43 108.125 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.4 p-10 -61.44 149.66 82.91 Favored Pre-proline 0 CA--C 1.541 0.618 0 O-C-N 121.705 -0.622 . . . . 61.01 110.645 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -67.71 -55.06 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.689 2.259 . . . . 74.12 110.034 -172.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -122.13 153.02 61.11 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 125.021 1.328 . . . . 63.14 108.081 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.73 106.67 0.95 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 122.697 2.265 . . . . 52.22 108.881 168.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -104.76 20.26 19.0 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.481 -0.762 . . . . 74.33 112.664 167.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.54 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.6 mp -66.58 165.27 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 107.476 -1.305 . . . . 71.04 107.476 171.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -102.04 146.79 27.4 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.801 2.04 . . . . 75.14 106.861 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 44.37 64.71 1.23 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 127.32 2.248 . . . . 73.02 111.248 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.09 -28.27 39.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.626 -1.17 . . . . 75.41 111.402 -178.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 27.6 p-90 -95.94 -5.45 41.34 Favored 'General case' 0 CA--C 1.521 -0.153 0 N-CA-C 113.452 0.908 . . . . 75.4 113.452 -173.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.244 0.813 0 N-CA-C 107.442 -1.318 . . . . 74.42 107.442 179.498 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 m . . . . . 0 N--CA 1.472 0.663 0 CA-C-O 121.082 0.467 . . . . 64.45 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -151.53 12.85 0.63 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.878 1.671 . . . . 73.42 111.649 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' VAL . 39.2 mt -116.99 142.4 31.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.658 -1.979 . . . . 72.34 105.658 168.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.9 t -118.87 133.07 66.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 105.949 -1.871 . . . . 74.32 105.949 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 36.1 ttp -116.48 118.29 32.26 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.019 -1.104 . . . . 65.44 108.019 -176.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.83 81.97 1.82 Allowed 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.759 0.824 . . . . 65.44 111.134 -164.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.23 156.16 37.54 Favored 'General case' 0 CA--C 1.513 -0.478 0 C-N-CA 123.091 0.556 . . . . 73.12 112.014 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.8 mtm 75.1 24.04 1.53 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.633 1.973 . . . . 74.24 111.856 -175.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tp -64.15 144.48 98.29 Favored Pre-proline 0 N--CA 1.453 -0.316 0 O-C-N 121.5 -0.75 . . . . 72.43 110.313 175.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.404 ' HG3' HE21 ' A' ' 73' ' ' GLN . 73.4 Cg_endo -73.34 155.34 51.18 Favored 'Trans proline' 0 N--CA 1.448 -1.157 0 C-N-CA 121.958 1.772 . . . . 74.4 108.453 167.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -77.33 -18.78 57.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.617 -0.719 . . . . 74.22 111.043 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.59 -38.84 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.052 0.941 . . . . 44.31 112.771 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.92 158.86 3.52 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.874 0.869 . . . . 62.11 110.898 -175.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -127.36 166.93 16.92 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.611 -0.885 . . . . 43.43 108.611 -168.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.23 -36.25 75.11 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.901 -0.499 . . . . 73.34 110.293 177.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -73.11 -24.24 60.61 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.922 0.489 . . . . 63.41 112.203 -174.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -62.27 -40.26 95.64 Favored 'General case' 0 C--N 1.337 0.048 0 N-CA-C 109.509 -0.552 . . . . 75.12 109.509 172.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 22' ' ' LEU . 9.7 mt -65.56 -51.11 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 N-CA-C 107.56 -1.274 . . . . 61.53 107.56 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HA ' HD12 ' A' ' 22' ' ' LEU . 33.4 mtp85 -55.85 -40.89 73.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.266 1.026 . . . . 61.3 110.313 -174.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.87 -38.37 85.0 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.17 -0.794 . . . . 74.34 112.542 173.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -75.12 -10.08 59.14 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.031 1.916 . . . . 71.3 113.317 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.836 HD13 ' CB ' ' A' ' 29' ' ' ALA . 9.0 mt -85.23 -54.26 4.72 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.591 1.156 . . . . 71.32 108.108 172.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.49 -17.14 43.25 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 125.116 1.366 . . . . 73.33 111.768 175.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . 0.286 4.5 t -43.66 -52.29 6.51 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 127.592 2.357 . . . . 75.21 110.408 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CD2' HG23 ' A' ' 27' ' ' VAL . 7.0 t60 -99.18 -31.77 11.57 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 128.416 2.686 . . . . 54.3 107.361 -173.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.61 12.9 5.36 Favored Glycine 0 C--N 1.341 0.838 0 C-N-CA 125.507 1.527 . . . . 65.23 113.334 -176.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.48 HG23 ' CD2' ' A' ' 25' ' ' HIS . 55.7 t -65.01 139.09 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 118.484 1.142 . . . . 54.21 110.259 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.07 -35.58 80.15 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 129.663 3.185 . . . . 61.32 116.274 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.836 ' CB ' HD13 ' A' ' 22' ' ' LEU . . . 43.54 74.83 0.11 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.132 1.773 . . . . 75.12 113.776 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.25 -36.25 72.95 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.408 0.683 . . . . 74.4 111.947 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -157.35 167.43 30.3 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.857 -0.794 . . . . 72.13 108.857 170.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.412 HG11 HD12 ' A' ' 18' ' ' ILE . 59.9 t -139.09 154.88 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 108.25 -1.018 . . . . 75.43 108.25 173.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -141.66 72.49 1.38 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 127.243 2.217 . . . . 74.13 108.559 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.789 HD22 ' H ' ' A' ' 35' ' ' MET . 0.4 OUTLIER -76.85 -170.06 1.49 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.828 1.299 . . . . 74.12 110.408 -176.226 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.789 ' H ' HD22 ' A' ' 34' ' ' LEU . 1.1 mtp -75.57 147.05 39.96 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 120.692 -1.255 . . . . 64.42 108.284 164.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 66.02 135.78 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.999 1.72 . . . . 75.33 110.787 -172.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -165.97 -42.76 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 113.376 -1.738 . . . . 73.03 111.459 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 55.42 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 1 C-N-CA 131.912 4.085 . . . . 55.32 117.269 -166.914 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.17 -44.66 12.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 124.402 1.081 . . . . 74.44 110.247 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.6 m -115.18 -2.74 12.65 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.459 1.281 . . . . 75.03 114.459 177.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.08 8.21 75.88 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.997 1.271 . . . . 61.33 112.123 161.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -56.71 127.1 29.85 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 128.156 2.582 . . . . 74.41 109.875 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 89.4 p -173.1 179.57 2.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.435 2.294 . . . . 74.53 111.418 161.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 174.73 -35.01 0.0 OUTLIER 'General case' 0 C--N 1.345 0.407 0 C-N-CA 129.619 3.167 . . . . 74.2 111.481 166.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 109.84 6.5 28.34 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.373 -1.091 . . . . 52.34 110.373 -153.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -143.84 159.33 42.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.02 1.728 . . . . 70.53 109.169 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.57 173.1 8.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.086 0.555 . . . . 44.24 109.739 157.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -108.0 140.52 41.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 105.945 -1.872 . . . . 74.21 105.945 145.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 3' ' ' ILE . 1.6 p -111.73 133.51 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 C-N-CA 125.23 1.412 . . . . 45.5 107.308 159.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -96.62 150.44 20.65 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.216 1.406 . . . . 72.25 108.875 173.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.452 ' CE2' ' CG1' ' A' ' 27' ' ' VAL . 6.0 m-85 -129.93 158.27 39.99 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.111 2.164 . . . . 70.12 107.335 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.19 -5.37 14.21 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.092 0.957 . . . . 54.55 112.427 -177.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -130.35 130.6 44.62 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 105.967 -1.864 . . . . 74.02 105.967 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.406 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -56.14 -30.22 61.84 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.281 1.032 . . . . 70.35 113.542 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -79.2 -37.82 37.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.971 0.805 . . . . 70.34 110.909 -168.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.41 -25.23 64.04 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.606 -0.683 . . . . 63.12 110.97 -170.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.03 -51.3 68.54 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.288 -1.005 . . . . 74.13 108.288 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -39.74 80.98 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.98 -0.378 . . . . 65.23 109.98 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -48.98 -50.62 34.85 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.559 0.744 . . . . 73.41 109.59 175.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.68 -42.65 91.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.369 0.418 . . . . 72.21 110.936 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.7 mtm -63.85 -61.48 2.26 Favored 'General case' 0 C--N 1.337 0.064 0 CA-C-N 118.157 0.435 . . . . 74.22 111.148 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -68.85 -37.62 79.24 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.732 0.813 . . . . 73.54 109.977 -166.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.43 -44.58 76.41 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 122.502 0.321 . . . . 51.44 110.378 174.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -88.0 12.18 14.05 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.022 0.529 . . . . 70.24 112.206 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 57.79 27.25 14.19 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.558 1.143 . . . . 72.3 110.486 176.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.4 m170 67.82 9.18 6.94 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.487 2.315 . . . . 72.1 115.164 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -146.83 103.2 3.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 121.948 2.158 . . . . 44.14 113.828 -174.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 56.2 mt -84.16 -179.27 7.18 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.563 1.945 . . . . 62.24 112.165 178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -145.29 109.14 4.75 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.787 0.835 . . . . 64.21 109.949 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.7 mp -129.06 131.74 67.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 124.727 1.211 . . . . 71.54 107.985 -171.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 53.45 21.87 2.62 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.983 1.313 . . . . 60.12 110.868 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.72 -12.0 70.01 Favored Glycine 0 C--N 1.341 0.821 0 C-N-CA 125.782 1.658 . . . . 51.44 114.316 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.404 HE21 ' HG3' ' A' ' 10' ' ' PRO . 3.8 mp0 -82.87 142.07 31.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.042 1.921 . . . . 73.13 108.253 -178.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -62.73 131.44 48.93 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.007 -1.108 . . . . 72.43 108.007 165.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.5 t -122.06 157.31 26.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 106.694 -1.595 . . . . 74.4 106.694 174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.2 m -128.6 147.86 50.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.179 1.392 . . . . 70.53 109.534 173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.17 147.47 43.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.932 0.893 . . . . 64.24 111.654 177.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -143.63 157.14 44.64 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.6 1.56 . . . . 74.13 108.85 -178.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -85.83 79.33 9.3 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.507 1.523 . . . . 70.54 110.032 165.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.59 77.59 0.18 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 105.516 -2.031 . . . . 72.14 105.516 153.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.28 161.9 37.44 Favored Pre-proline 0 CA--C 1.541 0.624 0 O-C-N 120.998 -1.064 . . . . 74.15 109.108 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.17 -33.58 3.41 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 CA-C-N 120.372 1.169 . . . . 54.13 113.129 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HB2' ' HD2' ' A' ' 84' ' ' PRO 0.29 14.3 ptpt 54.43 165.95 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 129.526 3.13 . . . . 65.31 113.876 -170.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.456 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 70.0 Cg_endo -65.94 105.6 0.84 Allowed 'Trans proline' 0 N--CA 1.445 -1.327 0 N-CA-C 106.458 -2.17 . . . . 73.12 106.458 159.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -114.0 17.22 17.99 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.745 1.218 . . . . 62.23 112.717 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.495 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.2 mp -78.83 165.83 2.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 125.955 1.702 . . . . 72.31 108.872 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.43 -6.03 9.28 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.88 1.067 . . . . 71.25 113.88 162.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -120.09 103.13 9.02 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 126.686 1.994 . . . . 51.21 107.183 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.62 -6.12 9.71 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 125.266 1.427 . . . . 64.04 110.9 -174.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 33.8 p-90 -136.42 10.11 3.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.972 2.109 . . . . 74.43 110.719 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.068 1.747 . . . . 71.15 108.597 176.462 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 121.852 0.834 . . . . 64.45 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -135.16 12.88 3.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 128.399 2.68 . . . . 62.01 110.003 163.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mt -126.91 128.89 71.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 127.345 2.258 . . . . 75.33 106.399 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 95.2 t -119.53 111.07 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 128.413 2.685 . . . . 73.12 105.72 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.93 115.89 27.57 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.132 -1.062 . . . . 72.21 108.132 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -86.33 99.8 11.85 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 107.283 -1.377 . . . . 72.13 107.283 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -78.34 152.3 32.42 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.301 -1.0 . . . . 75.24 108.301 169.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 mtm 75.34 45.45 0.14 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.892 1.677 . . . . 63.12 112.124 171.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.36 143.78 42.41 Favored Pre-proline 0 C--O 1.238 0.487 0 O-C-N 121.299 -0.876 . . . . 60.24 109.746 168.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.426 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 55.8 Cg_endo -71.04 171.12 16.5 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.671 3.581 . . . . 73.14 110.749 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -71.15 -28.02 63.97 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.559 -0.734 . . . . 75.12 111.079 -177.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.02 -32.86 57.36 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.854 0.861 . . . . 51.31 112.6 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.426 ' HB2' ' HG2' ' A' ' 10' ' ' PRO . . . -44.92 125.43 5.1 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.079 1.352 . . . . 73.31 111.669 -167.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.7 p -99.32 161.99 13.3 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 122.495 1.14 . . . . 74.43 109.557 -178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.499 ' H ' ' HG2' ' A' ' 35' ' ' MET . 18.2 tt0 -67.9 -26.1 65.83 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 121.619 -0.676 . . . . 71.42 110.348 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.5 -37.46 74.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.583 1.553 . . . . 43.54 110.264 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -56.37 -43.11 78.89 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.46 1.104 . . . . 73.22 108.919 172.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.1 mt -65.94 -42.19 91.38 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 CA-C-O 118.474 -0.774 . . . . 75.11 109.866 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.2 mtt-85 -56.76 -44.18 81.5 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.783 1.174 . . . . 73.12 111.485 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.09 -45.14 96.69 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.326 -0.71 . . . . 14.2 111.326 174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -8.47 34.84 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 117.993 -1.003 . . . . 73.12 113.019 -178.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.541 ' CD1' ' HB2' ' A' ' 29' ' ' ALA . 51.0 mt -89.32 -57.74 2.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.013 1.279 . . . . 65.41 109.365 168.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -61.42 -27.19 68.37 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.379 -0.82 . . . . 71.33 111.969 -170.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.69 67.6 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.902 0.881 . . . . 74.11 110.994 174.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -75.83 -12.83 60.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.907 . . . . 70.22 112.145 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.69 -15.63 26.59 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.478 1.513 . . . . 53.34 112.092 175.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -77.83 155.61 5.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 C-N-CA 124.772 1.229 . . . . 61.15 108.395 -170.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.25 23.09 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 107.875 -1.157 . . . . 65.15 107.875 167.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . . . -74.15 147.71 42.39 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 119.337 0.971 . . . . 64.11 109.168 152.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.51 -26.62 8.22 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.044 -0.503 . . . . 74.42 111.407 166.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -141.16 155.94 46.01 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.941 -1.503 . . . . 75.3 106.941 164.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -140.33 156.43 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 108.155 -1.054 . . . . 51.54 108.155 170.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -156.4 83.71 0.98 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.552 1.941 . . . . 75.14 107.687 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD13 ' H ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -131.71 -153.39 0.55 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 129.007 2.923 . . . . 73.03 106.983 169.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.499 ' HG2' ' H ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER 57.05 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.75 1 C-N-CA 132.34 4.256 . . . . 74.43 110.346 -165.901 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.452 ' HA ' ' HB3' ' A' ' 43' ' ' SER . 0.1 OUTLIER 172.9 155.62 0.1 Allowed 'General case' 0 CA--C 1.502 -0.903 0 C-N-CA 127.1 2.16 . . . . 74.44 106.942 -167.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -164.84 -2.2 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.567 1.321 . . . . 71.03 114.567 170.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.18 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 119.049 2.981 . . . . 72.44 119.049 -165.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.6 p -89.82 -29.59 18.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 121.506 1.957 . . . . 73.4 113.918 -165.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.3 t -123.72 -43.83 2.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.249 0.833 . . . . 71.23 113.249 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.55 24.47 0.13 Allowed Glycine 0 CA--C 1.53 1.022 0 CA-C-O 118.373 -1.237 . . . . 52.32 114.885 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -65.63 8.15 0.19 Allowed 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 120.201 2.0 . . . . 63.34 115.179 -170.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.452 ' HB3' ' HA ' ' A' ' 36' ' ' ARG . 78.1 p -148.26 93.54 2.18 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 120.524 -1.36 . . . . 72.4 112.713 -173.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -132.62 20.83 4.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.532 0.733 . . . . 74.53 112.082 174.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.88 15.41 73.89 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 120.598 -1.314 . . . . 73.43 110.364 -162.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -157.62 160.14 37.75 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.945 1.698 . . . . 73.5 109.158 169.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.404 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . . . -147.01 177.58 9.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 128.383 2.673 . . . . 52.53 110.254 -163.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -139.16 78.32 1.66 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.69 1.196 . . . . 75.04 110.273 -167.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -63.41 143.44 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 119.747 -1.846 . . . . 52.51 107.631 169.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -113.93 134.99 54.47 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 120.289 1.404 . . . . 70.12 109.099 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -99.8 157.64 16.36 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.479 -0.934 . . . . 74.14 108.479 162.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.53 -15.47 45.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.662 -0.699 . . . . 73.05 112.825 177.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -128.53 134.12 48.59 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.901 -1.148 . . . . 72.21 107.901 -170.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.9 -6.16 20.45 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.529 0.936 . . . . 72.05 113.529 -177.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -99.23 -16.16 18.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.401 1.08 . . . . 74.12 113.444 173.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -73.52 -34.44 65.25 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.048 -0.723 . . . . 74.11 109.048 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.07 -51.56 69.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.697 0.799 . . . . 73.32 109.115 175.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -41.22 72.93 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.585 0.754 . . . . 62.34 111.237 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -64.49 -30.39 71.42 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 119.382 -0.342 . . . . 73.45 111.371 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -76.76 -50.92 12.39 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 117.893 0.315 . . . . 72.44 110.365 170.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.0 mmm -61.43 -57.93 10.25 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.98 1.312 . . . . 71.34 111.956 -171.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.45 -39.05 86.16 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.197 0.599 . . . . 65.31 110.018 -177.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.23 64.6 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.857 0.463 . . . . 73.15 111.86 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -90.72 -9.67 45.85 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 118.645 -0.693 . . . . 71.42 112.009 171.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 62.99 30.63 16.37 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.585 1.154 . . . . 72.14 109.345 -175.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.6 m170 70.44 16.44 7.09 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.403 2.281 . . . . 74.12 113.852 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.8 p -142.27 123.42 14.62 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.477 1.132 . . . . 75.12 112.339 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.09 173.57 6.25 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.564 -1.198 . . . . 73.12 111.746 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -149.53 77.84 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 113.241 -1.799 . . . . 55.34 112.296 -170.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.438 HD12 HG21 ' A' ' 75' ' ' VAL . 2.6 mp -101.21 132.02 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 106.618 -1.623 . . . . 73.14 106.618 -177.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 mp 57.5 14.61 2.35 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.172 1.389 . . . . 75.43 112.543 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.75 -0.85 88.13 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.533 1.063 . . . . 54.25 112.978 -177.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.93 153.59 42.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.705 1.253 . . . . 72.25 108.091 167.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.71 139.69 30.21 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 106.348 -1.723 . . . . 72.35 106.348 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.438 HG21 HD12 ' A' ' 70' ' ' ILE . 38.4 t -130.24 144.67 37.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.327 -1.731 . . . . 74.24 106.327 -177.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -112.03 156.31 22.38 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.857 -1.164 . . . . 64.53 107.857 170.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 ptm -131.32 142.66 50.13 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.219 0.608 . . . . 72.42 110.159 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -144.18 152.32 40.72 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.468 1.507 . . . . 75.54 108.478 -168.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -88.6 101.35 13.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.156 0.583 . . . . 73.54 109.853 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.26 50.27 0.86 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.616 1.566 . . . . 61.44 110.298 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -48.66 146.68 4.92 Favored Pre-proline 0 N--CA 1.467 0.392 0 C-N-CA 124.61 1.164 . . . . 71.1 112.666 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.21 -32.54 8.26 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.834 1.689 . . . . 63.14 112.935 -167.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -156.4 162.47 27.44 Favored Pre-proline 0 C--O 1.235 0.328 0 C-N-CA 125.295 1.438 . . . . 60.01 109.402 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.46 91.87 0.86 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.141 2.561 . . . . 73.01 110.245 174.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -106.97 44.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 O-C-N 120.522 -1.361 . . . . 73.4 110.142 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.638 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -69.61 154.05 8.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 106.3 -1.741 . . . . 74.13 106.3 162.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -59.38 133.19 55.87 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 107.36 -1.348 . . . . 63.25 107.36 159.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 43.63 58.03 3.71 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 126.859 2.064 . . . . 61.44 113.343 155.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.02 -5.28 16.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.426 2.29 . . . . 74.24 112.979 -175.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 66.4 p-90 -126.98 8.8 6.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.528 1.531 . . . . 73.33 112.682 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.5 mp . . . . . 0 C--O 1.247 0.934 0 N-CA-C 106.425 -1.694 . . . . 73.12 106.425 170.759 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.465 0.289 0 N-CA-C 108.743 -0.836 . . . . 70.32 108.743 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -134.68 21.64 3.6 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.449 1.1 . . . . 70.11 111.928 178.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 87.1 mt -123.08 133.7 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 118.98 0.809 . . . . 72.25 109.396 167.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.6 t -107.45 119.05 56.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 N-CA-C 106.251 -1.759 . . . . 74.25 106.251 168.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 6.1 mtp -74.35 139.18 43.95 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 106.53 -1.656 . . . . 73.24 106.53 156.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -121.1 88.62 2.97 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 107.281 -1.378 . . . . 74.23 107.281 175.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 75' ' ' VAL . 10.5 mtt-85 -77.13 161.36 28.29 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 118.706 0.684 . . . . 75.24 110.569 -177.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.4 mtm 76.2 14.34 2.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.893 2.077 . . . . 54.31 112.849 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 37.1 mt -63.2 148.17 93.51 Favored Pre-proline 0 C--O 1.241 0.625 0 C-N-CA 124.715 1.206 . . . . 73.22 110.807 170.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.04 -178.81 1.85 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 124.021 3.148 . . . . 72.51 111.586 166.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -98.82 -6.25 29.54 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.542 1.137 . . . . 74.45 111.703 169.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.57 -51.4 23.59 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.526 1.13 . . . . 71.13 109.915 175.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 161.4 10.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 122.946 1.355 . . . . 42.41 111.215 -169.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -130.96 178.02 6.99 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 126.54 1.936 . . . . 63.23 108.953 -170.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.23 -43.26 96.21 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 125.76 1.624 . . . . 75.51 110.302 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.4 -28.96 69.63 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.64 0.607 . . . . 72.51 112.64 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -56.58 -49.93 73.42 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.454 -0.943 . . . . 71.21 108.454 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 83.9 mt -67.38 -45.19 86.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 C-N-CA 123.372 0.669 . . . . 71.13 109.319 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -61.53 -29.3 69.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.947 0.794 . . . . 74.33 112.407 -172.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.46 -23.33 31.67 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-O 118.55 -1.139 . . . . 33.13 112.903 173.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -57.22 -47.98 79.96 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 120.005 1.903 . . . . 62.14 108.836 175.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.31 -32.55 72.76 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.695 -0.628 . . . . 71.4 110.809 -175.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -64.36 -20.0 65.84 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 117.164 -1.398 . . . . 62.33 112.001 175.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.8 t -63.22 -17.1 62.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 121.48 1.946 . . . . 72.42 110.65 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -118.86 0.26 11.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.632 1.973 . . . . 73.53 112.491 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.91 6.73 81.99 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 125.326 1.441 . . . . 54.21 113.56 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -87.23 159.91 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 118.888 1.344 . . . . 74.53 107.702 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -88.96 -41.47 12.37 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.943 1.09 . . . . 65.52 113.943 -172.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 45.15 104.13 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.992 2.117 . . . . 73.43 112.753 -148.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -77.95 -35.18 50.64 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 121.359 -0.838 . . . . 64.15 111.977 -170.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -139.58 146.12 39.45 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 106.968 -1.493 . . . . 61.53 106.968 173.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 t -140.15 87.41 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.376 0 O-C-N 120.849 -1.157 . . . . 62.32 109.928 -164.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -75.76 74.87 2.73 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.259 -0.901 . . . . 72.43 111.24 175.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.554 HD23 ' HB2' ' A' ' 47' ' ' ALA . 1.6 tm? -131.75 124.74 30.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 105.104 -2.184 . . . . 75.25 105.104 165.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.446 ' HG3' ' H ' ' A' ' 36' ' ' ARG . 7.1 ptm -169.11 -87.05 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.958 1.708 . . . . 73.41 113.882 155.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' H ' ' HG3' ' A' ' 35' ' ' MET . 19.7 mmt85 -153.92 -55.58 0.11 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.809 1.644 . . . . 64.54 110.21 -174.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 59.71 -33.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.185 1 C-N-CA 132.099 4.16 . . . . 63.24 117.653 174.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.368 0.0 OUTLIER 46.22 -70.4 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 126.525 1.93 . . . . 62.14 115.671 -141.085 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.22 -65.27 0.59 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 126.254 1.822 . . . . 74.45 113.346 -164.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.51 -39.39 77.58 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.528 -0.732 . . . . 73.44 111.114 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.03 57.68 2.63 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 107.067 -2.413 . . . . 74.23 107.067 -175.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -78.73 29.8 0.2 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.208 1.803 . . . . 75.43 110.689 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.1 p -163.76 9.71 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.779 1.029 . . . . 75.33 113.779 -160.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 90.1 mtt180 -76.9 -6.78 53.83 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.239 -0.913 . . . . 71.42 111.732 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 131.3 5.94 3.6 Favored Glycine 0 CA--C 1.523 0.568 0 CA-C-N 119.233 0.924 . . . . 71.22 113.409 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -149.54 142.99 25.33 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 119.109 1.455 . . . . 64.54 112.456 175.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.554 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -85.0 174.3 9.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.971 1.309 . . . . 31.13 110.565 165.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -129.24 94.6 3.84 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 105.856 -1.905 . . . . 73.12 105.856 153.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.35 117.96 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.291 -1.003 . . . . 61.21 108.291 -178.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.56 143.62 26.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 119.651 1.114 . . . . 73.51 109.64 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -122.5 139.88 53.38 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.729 1.611 . . . . 62.11 108.471 -170.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.7 m -66.92 -27.39 67.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 118.881 -0.581 . . . . 73.34 112.063 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -134.33 123.11 23.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.478 -0.934 . . . . 70.54 108.478 -174.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -58.82 -25.99 63.71 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.826 0.676 . . . . 71.4 112.826 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.16 -40.69 70.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.755 0.707 . . . . 71.12 110.312 171.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -73.73 -25.35 60.15 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.78 -0.575 . . . . 73.22 109.726 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.26 -54.0 24.84 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 107.433 -1.321 . . . . 50.22 107.433 -174.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.7 m -61.74 -36.75 81.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.155 0.982 . . . . 65.12 110.811 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.5 ttt180 -60.17 -39.88 88.0 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.048 -1.032 . . . . 72.22 110.474 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -67.57 -47.28 70.26 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.522 0.601 . . . . 75.11 110.295 175.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.35 -64.07 0.98 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.371 1.468 . . . . 64.12 112.65 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.28 -31.69 72.65 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 122.364 -0.21 . . . . 71.13 111.421 -164.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.82 -12.58 61.68 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 125.672 1.589 . . . . 70.43 112.798 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -108.4 -2.57 18.98 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.106 0.962 . . . . 71.44 111.856 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 54.25 35.55 22.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 122.312 1.053 . . . . 70.34 109.153 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 17.8 m170 57.88 27.2 14.28 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.091 1.756 . . . . 63.15 114.832 -176.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.4 m -131.54 119.35 21.4 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 120.426 1.467 . . . . 35.23 111.054 169.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 67.6 mt -91.73 174.23 7.46 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.274 0.559 . . . . 72.41 109.855 166.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -142.08 108.28 5.24 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 124.926 1.29 . . . . 73.32 108.585 175.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.6 mp -121.9 123.74 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 N-CA-C 106.597 -1.631 . . . . 73.21 106.597 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.8 mp 49.49 49.11 20.43 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.019 1.327 . . . . 75.23 109.054 -176.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.75 -10.58 1.48 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 126.491 1.996 . . . . 43.01 115.181 174.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -80.82 130.79 35.24 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 106.455 -1.683 . . . . 55.03 106.455 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -63.34 138.62 58.59 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 107.214 -1.402 . . . . 74.54 107.214 166.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 7' ' ' ARG . 58.9 t -131.71 140.55 47.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 105.978 -1.86 . . . . 64.53 105.978 -178.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.2 p -108.91 151.74 25.88 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.636 0.774 . . . . 61.03 109.783 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.1 ptm -124.54 144.07 50.33 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.428 0.632 . . . . 75.12 112.685 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -147.66 139.58 24.14 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 126.065 1.746 . . . . 75.24 108.788 -167.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -73.55 85.63 1.57 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.985 1.714 . . . . 73.01 110.825 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 t -90.96 51.63 2.0 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 121.515 -0.74 . . . . 63.34 109.469 176.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.9 p30 -56.03 159.12 6.07 Favored Pre-proline 0 CA--C 1.537 0.48 0 O-C-N 122.269 -0.27 . . . . 64.2 111.374 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -74.78 -19.8 18.05 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 120.602 0.868 . . . . 54.23 113.114 -155.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . 0.4 11.2 ptpt 54.56 155.77 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.561 0 C-N-CA 128.166 2.587 . . . . 62.23 111.249 -158.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -59.49 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.424 -2.596 0 CA-C-O 126.043 2.435 . . . . 41.51 108.164 161.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.58 99.34 5.97 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 111.539 -2.573 . . . . 71.12 106.441 162.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.0 mt -123.75 138.94 51.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 127.9 2.48 . . . . 73.12 105.092 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -91.78 156.43 17.54 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.431 -1.259 . . . . 60.44 109.27 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 46.35 50.43 12.33 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 124.851 2.262 . . . . 74.24 109.329 -173.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -71.58 -6.77 43.3 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.297 2.239 . . . . 73.02 113.713 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -134.73 4.29 3.31 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 129.709 3.204 . . . . 74.25 111.378 -175.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.258 1.542 0 C-N-CA 125.571 1.548 . . . . 62.21 109.216 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 119.012 -0.518 . . . . 62.23 109.695 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.07 -22.82 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 129.644 3.178 . . . . 64.23 109.208 171.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.1 mt -109.06 126.73 66.09 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.654 0 CA-C-N 120.724 1.602 . . . . 70.05 106.938 173.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -103.5 143.11 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 107.642 -1.244 . . . . 74.55 107.642 167.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.482 ' HB2' ' HB2' ' A' ' 80' ' ' SER . 7.3 ttt -115.6 105.31 12.62 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 129.428 3.091 . . . . 73.23 107.142 -177.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -91.71 89.6 7.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.02 -1.474 . . . . 73.31 107.02 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.403 HH21 ' CE1' ' A' ' 78' ' ' HIS . 17.0 mtm180 -72.75 152.62 41.53 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.02 -0.733 . . . . 72.04 109.02 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.6 mtm 72.31 59.52 0.13 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.75 2.02 . . . . 71.23 113.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.4 mt -89.42 153.89 48.52 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 120.843 -1.161 . . . . 74.34 111.31 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.65 173.36 9.1 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.207 2.605 . . . . 75.22 109.155 163.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -81.17 -28.93 34.81 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 118.998 -0.525 . . . . 75.42 110.518 172.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.9 -35.57 80.31 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 114.09 1.145 . . . . 51.43 114.09 -174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.0 144.57 33.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 123.594 0.559 . . . . 55.33 110.994 -168.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.546 ' H ' ' HB2' ' A' ' 17' ' ' ASP . 48.9 p -116.12 168.46 10.08 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.44 1.496 . . . . 53.12 109.842 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.47 ' N ' HD12 ' A' ' 34' ' ' LEU . 3.1 tt0 -52.9 -36.53 59.52 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.552 0.692 . . . . 73.31 110.323 172.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -77.65 -28.38 51.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.789 -0.641 . . . . 62.54 112.433 -177.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.546 ' HB2' ' H ' ' A' ' 14' ' ' THR . 0.9 OUTLIER -68.92 -28.17 66.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.284 0.634 . . . . 74.32 111.459 174.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 71.4 mt -60.73 -66.57 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 N-CA-C 105.37 -2.085 . . . . 61.53 105.37 160.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -55.97 -33.4 64.75 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.262 1.208 . . . . 75.31 114.262 -161.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.31 -30.71 74.8 Favored Glycine 0 CA--C 1.536 1.385 0 CA-C-N 118.704 0.684 . . . . 53.13 113.313 175.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -18.96 63.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.095 1.358 . . . . 65.15 111.896 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -86.22 -44.1 12.44 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.633 -1.988 . . . . 72.12 105.633 -168.463 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -54.19 -39.71 66.89 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 114.092 1.145 . . . . 71.55 114.092 168.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.1 m -55.56 -24.91 35.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.265 0.626 . . . . 70.31 112.379 176.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -112.64 -0.4 15.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.249 1.019 . . . . 63.11 113.289 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.87 36.93 20.86 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 120.753 -1.217 . . . . 72.41 112.871 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -125.56 162.28 28.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 107.348 -1.353 . . . . 74.23 107.348 -173.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -104.61 142.75 34.1 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.594 -1.632 . . . . 71.15 106.594 158.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . . . -84.32 92.83 8.1 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.335 -0.987 . . . . 43.32 108.335 151.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -69.92 -26.64 64.25 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 123.816 0.846 . . . . 74.23 111.955 -174.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -143.04 147.65 35.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.803 -1.184 . . . . 63.45 107.803 166.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.1 t -142.93 141.23 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.281 1.832 . . . . 63.45 107.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.6 mtp85 -133.44 66.68 1.55 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.587 2.355 . . . . 72.03 105.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.749 HD13 ' N ' ' A' ' 35' ' ' MET . 2.8 tm? -106.28 177.59 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 128.272 2.629 . . . . 64.51 108.146 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.749 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -49.26 178.68 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.673 1.189 . . . . 55.32 113.804 169.405 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HG2' ' HG3' ' A' ' 35' ' ' MET . 1.2 mmm180 77.18 -12.67 1.03 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 128.57 2.748 . . . . 71.53 112.467 -179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.68 -52.15 7.88 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-N 119.838 1.199 . . . . 60.45 111.851 -170.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 65.11 -48.26 0.35 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.357 2.263 . . . . 73.31 116.557 175.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.0 t -61.7 -59.2 5.53 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 120.964 1.711 . . . . 74.34 107.826 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.5 p -62.95 -22.05 66.51 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.746 0.647 . . . . 72.44 112.746 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 99.5 18.56 23.19 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 121.58 -0.7 . . . . 62.35 112.242 161.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -59.04 -162.76 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.979 2.112 . . . . 75.42 113.339 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 75.95 50.16 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 130.439 3.496 . . . . 42.14 116.548 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -92.98 13.76 19.72 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.661 1.726 . . . . 73.43 115.661 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.15 14.53 71.28 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 121.455 1.934 . . . . 63.21 110.674 -173.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -145.54 171.19 15.03 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 126.91 2.084 . . . . 61.51 107.224 167.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 34' ' ' LEU . . . -133.57 145.86 50.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 109.157 -0.683 . . . . 72.55 109.157 164.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -87.97 132.65 34.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 105.562 -2.014 . . . . 73.33 105.562 162.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 86.8 t -131.2 109.03 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 105.461 -2.051 . . . . 63.21 105.461 177.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -103.73 121.89 43.93 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 126.202 1.801 . . . . 71.04 107.787 -171.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -93.09 149.69 21.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.505 1.048 . . . . 74.33 111.265 -168.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -34.72 78.84 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.122 -0.466 . . . . 71.14 109.811 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -118.78 146.7 44.6 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.052 0.541 . . . . 70.25 109.602 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.4 -41.79 96.46 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.354 -0.384 . . . . 54.12 110.338 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -75.98 -18.72 59.19 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 120.789 -1.194 . . . . 74.22 112.745 -172.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.52 -29.35 69.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.42 0.688 . . . . 74.12 109.914 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.8 -55.61 32.7 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.271 -1.011 . . . . 65.44 108.271 176.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -47.9 71.64 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 123.191 0.596 . . . . 62.34 111.649 174.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -53.7 -38.17 63.99 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.729 -0.841 . . . . 74.24 108.729 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -55.93 8.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.393 0.677 . . . . 63.22 110.919 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.2 mmm -60.05 -52.09 66.85 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.836 1.655 . . . . 74.51 112.33 -171.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.89 -42.28 98.89 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.631 1.572 . . . . 71.24 109.136 -175.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.43 -4.92 29.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.359 1.064 . . . . 61.31 111.995 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -121.85 -2.11 9.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 125.05 1.34 . . . . 72.44 111.173 177.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 56.18 33.54 22.27 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.422 1.089 . . . . 54.42 108.601 -178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.2 m170 69.08 9.87 7.61 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.807 1.643 . . . . 73.51 114.821 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 5.8 p -126.16 115.06 19.19 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 120.737 1.608 . . . . 73.54 110.373 -178.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.8 mt -96.44 169.58 9.81 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.394 0.678 . . . . 72.53 109.592 168.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -144.51 120.02 10.36 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.462 1.105 . . . . 63.33 109.342 173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.4 mp -125.59 117.46 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 125.454 1.502 . . . . 41.34 107.532 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.4 mt 58.76 26.5 14.77 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.165 1.386 . . . . 75.11 110.863 176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.93 -18.56 55.65 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 126.26 1.886 . . . . 62.55 113.638 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -80.5 137.95 36.5 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 120.3 2.05 . . . . 75.31 108.85 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -70.39 126.19 28.95 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.496 -0.927 . . . . 74.53 108.496 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 37.7 t -121.08 142.85 35.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 N-CA-C 105.649 -1.982 . . . . 74.23 105.649 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.5 m -117.09 118.23 31.8 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.354 -0.841 . . . . 71.52 109.515 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.6 147.71 28.43 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.941 0.4 . . . . 71.54 111.54 173.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 7' ' ' ARG . 30.1 m-70 -135.78 156.97 47.99 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 127.635 2.374 . . . . 70.11 107.133 169.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -71.79 150.83 44.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.809 1.186 . . . . 62.31 110.043 159.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.482 ' HB2' ' HB2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -153.82 46.33 0.62 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.667 1.187 . . . . 61.14 108.996 175.082 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.65 55.83 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.382 -0.372 . . . . 70.11 110.35 179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.25 -14.97 20.45 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.636 1.558 . . . . 73.34 113.904 -168.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt 56.91 165.56 0.07 OUTLIER Pre-proline 0 C--O 1.236 0.357 0 C-N-CA 130.051 3.341 . . . . 72.42 113.313 -171.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.31 98.89 0.47 Allowed 'Trans proline' 0 N--CA 1.448 -1.199 0 N-CA-C 107.272 -1.857 . . . . 71.04 107.272 163.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -116.84 43.25 2.3 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.895 2.078 . . . . 73.15 107.926 -173.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -95.04 156.98 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 105.963 -1.866 . . . . 73.01 105.963 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -5.53 59.07 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.108 0.781 . . . . 73.03 113.108 171.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -141.24 105.13 4.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 128.109 2.564 . . . . 73.32 106.105 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -125.82 3.57 7.4 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.399 1.08 . . . . 71.22 110.496 -168.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -142.77 10.32 1.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.332 3.053 . . . . 74.14 110.485 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.249 1.049 0 C-N-CA 124.323 1.049 . . . . 61.25 108.194 167.442 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 CA--C 1.512 -0.486 0 N-CA-C 109.375 -0.602 . . . . 75.14 109.375 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 72.96 -1.46 3.03 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 130.953 3.701 . . . . 41.14 109.175 -178.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.9 mt -143.42 142.3 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 106.934 -1.506 . . . . 54.4 106.934 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 49' ' ' VAL . 1.1 p -139.57 107.57 3.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 1 C-N-CA 133.049 4.54 . . . . 63.44 108.554 -176.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.4 ttp -77.35 117.11 18.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.548 -1.279 . . . . 74.14 107.548 165.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -86.39 112.4 21.42 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 105.366 -2.087 . . . . 72.43 105.366 171.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -97.72 158.92 15.24 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.221 0.919 . . . . 73.2 109.372 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.7 mtm 69.48 48.32 0.63 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.948 1.699 . . . . 74.23 111.138 175.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.8 mt -92.54 152.72 42.3 Favored Pre-proline 0 C--O 1.232 0.168 0 O-C-N 121.279 -0.888 . . . . 74.12 111.547 174.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.632 ' HB3' HE21 ' A' ' 73' ' ' GLN . 93.1 Cg_endo -80.08 166.87 20.47 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.657 2.238 . . . . 74.14 111.723 163.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -81.47 -23.66 37.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.37 1.068 . . . . 73.31 111.809 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.62 -33.71 66.85 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.615 1.098 . . . . 75.33 111.877 -175.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.82 160.11 0.49 Allowed 'General case' 0 C--O 1.237 0.409 0 C-N-CA 126.09 1.756 . . . . 44.34 112.656 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.4 p -130.59 164.65 24.46 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 122.026 -0.421 . . . . 73.22 111.196 -175.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -57.04 -40.37 76.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.776 -0.824 . . . . 64.31 108.776 170.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.09 -36.3 81.3 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.908 1.683 . . . . 61.11 112.595 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -61.22 -42.58 98.85 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.814 -0.439 . . . . 74.24 109.814 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 34' ' ' LEU . 3.3 mt -68.89 -47.99 72.96 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.218 0 N-CA-C 108.631 -0.877 . . . . 72.45 108.631 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.586 ' HA ' HD12 ' A' ' 22' ' ' LEU . 46.7 mtp85 -56.47 -34.33 66.8 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.626 0.77 . . . . 53.34 110.46 -174.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.88 -43.38 74.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.254 -0.748 . . . . 61.02 112.107 172.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -50.26 73.76 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 118.904 1.352 . . . . 73.43 108.324 175.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 29' ' ' ALA . 7.5 mt -58.89 -46.06 88.75 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.374 1.07 . . . . 71.14 110.339 -172.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -58.58 -38.92 78.94 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.959 1.303 . . . . 71.32 110.663 177.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.62 -31.85 66.65 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.505 1.522 . . . . 61.14 111.754 177.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.459 ' CE1' HD21 ' A' ' 64' ' ' ASN . 76.7 m-70 -91.4 -10.88 39.47 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.482 -0.761 . . . . 74.22 112.325 175.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.2 17.03 7.95 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 124.986 1.279 . . . . 53.24 112.908 171.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.6 t -124.29 140.57 47.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.392 1.596 . . . . 74.12 110.988 -160.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -69.28 -28.88 66.68 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.982 1.313 . . . . 72.31 112.725 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.784 ' HB2' HD13 ' A' ' 22' ' ' LEU . . . 44.21 90.97 0.01 OUTLIER 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.043 1.737 . . . . 72.31 111.472 -152.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -61.18 -33.05 72.82 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.717 -0.674 . . . . 72.0 110.185 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.76 153.71 50.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.285 0.948 . . . . 52.21 109.591 167.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.254 1.5 p -159.84 115.96 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 123.883 0.873 . . . . 73.11 111.31 168.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.6 mtm-85 -89.49 80.56 6.7 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.136 -1.061 . . . . 75.31 108.136 171.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.612 HD22 ' H ' ' A' ' 35' ' ' MET . 1.4 tm? -74.21 165.58 24.92 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-O 121.959 0.885 . . . . 55.11 109.239 167.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.612 ' H ' HD22 ' A' ' 34' ' ' LEU . 50.9 mtp -58.58 13.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 129.884 3.274 . . . . 54.41 116.771 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 91.0 mtt-85 -138.44 118.83 13.74 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 120.368 -1.458 . . . . 60.42 107.386 173.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -177.11 118.56 0.11 Allowed 'General case' 0 C--O 1.237 0.399 0 C-N-CA 128.415 2.686 . . . . 52.1 107.633 159.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -22.56 66.5 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.936 1.244 . . . . 63.42 112.865 174.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -61.27 -32.4 72.23 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.57 1.148 . . . . 72.33 111.237 -169.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.1 t -130.65 -38.68 1.3 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.311 1.845 . . . . 75.14 109.139 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.98 21.59 55.07 Favored Glycine 0 C--N 1.341 0.835 0 O-C-N 121.408 -0.807 . . . . 75.34 112.223 -171.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.41 ' HG2' ' H ' ' A' ' 42' ' ' GLN . 1.9 pt20 -44.61 105.76 0.06 Allowed 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 127.181 2.193 . . . . 63.44 107.642 167.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 58.0 p -177.23 156.57 1.25 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.922 2.489 . . . . 43.14 111.271 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 174.34 2.54 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 129.208 3.003 . . . . 75.21 114.385 169.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 93.69 3.14 64.6 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-N 120.61 1.55 . . . . 60.44 111.408 -165.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.45 165.0 25.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.885 1.274 . . . . 63.01 108.88 167.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.68 170.33 16.13 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.159 2.184 . . . . 60.01 108.877 176.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -124.05 131.85 53.6 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 116.811 -1.566 . . . . 75.41 107.003 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.492 ' HB ' HG13 ' A' ' 4' ' ' VAL . 28.0 t -104.13 150.58 7.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 105.288 -2.116 . . . . 74.33 105.288 162.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -122.76 155.51 36.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 122.137 0.97 . . . . 75.32 110.717 169.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' A' ' 57' ' ' ALA . 98.9 m-85 -130.66 100.35 5.27 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 114.646 -1.161 . . . . 54.55 109.388 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.7 t -47.46 -28.68 2.27 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.498 0.719 . . . . 74.42 112.071 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -71.79 -5.16 32.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.783 1.233 . . . . 44.31 112.312 -174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.01 -27.73 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 128.488 2.715 . . . . 72.12 114.781 -173.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -122.0 -21.92 5.84 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.453 1.901 . . . . 53.22 112.844 -163.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -12.51 61.63 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.424 -0.798 . . . . 63.04 109.518 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' PHE . . . -53.48 -51.88 61.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.152 1.381 . . . . 61.44 107.801 172.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -42.08 80.26 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.665 -0.698 . . . . 74.11 110.927 179.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -26.06 65.33 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 123.437 0.461 . . . . 64.13 110.372 -176.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -80.24 -47.68 14.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.648 0.658 . . . . 71.24 111.183 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.6 mmm -65.45 -50.05 66.84 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.239 1.016 . . . . 73.11 112.199 -170.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -70.29 -27.72 64.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.448 0.642 . . . . 75.23 110.304 -178.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.02 -1.21 16.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.036 0.534 . . . . 62.34 111.998 174.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.459 HD21 ' CE1' ' A' ' 25' ' ' HIS . 62.7 m-80 -123.64 0.38 8.73 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.424 1.49 . . . . 62.01 111.768 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 62.2 28.38 17.01 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.45 -0.782 . . . . 64.44 109.401 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 8.9 m170 65.03 17.63 11.16 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.999 1.72 . . . . 75.21 115.236 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.83 134.71 32.1 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.602 1.092 . . . . 72.14 109.154 171.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.51 178.2 4.45 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 124.422 1.089 . . . . 71.13 109.817 173.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -150.32 115.24 5.32 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 125.065 1.346 . . . . 74.33 108.892 173.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 mp -124.76 129.26 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 106.042 -1.836 . . . . 74.02 106.042 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 mt 68.21 -13.8 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.113 2.565 . . . . 74.35 113.126 -177.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.91 -13.39 5.54 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.5 1.524 . . . . 73.23 113.283 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.632 HE21 ' HB3' ' A' ' 10' ' ' PRO . 2.2 pm0 -95.73 132.09 41.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.269 1.428 . . . . 75.15 110.209 -177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -69.23 141.41 54.46 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.741 1.217 . . . . 75.41 108.693 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 21.7 t -130.22 136.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.215 -1.772 . . . . 74.31 106.215 -174.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 m -93.59 160.63 14.7 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.417 -0.586 . . . . 53.24 109.417 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.412 ' HB2' HG23 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -134.04 137.56 44.77 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.04 0.536 . . . . 55.54 110.081 170.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -137.12 128.72 28.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 105.593 -2.003 . . . . 73.24 105.593 -177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -68.9 119.48 13.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 120.562 1.528 . . . . 73.04 110.107 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.01 46.84 1.04 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.712 0.805 . . . . 40.5 108.976 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.5 p30 -57.44 148.05 56.35 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 112.326 0.491 . . . . 64.03 112.326 -167.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -77.09 -23.11 10.77 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 N-CA-C 114.77 1.027 . . . . 62.32 114.77 -149.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.0 ptpt 54.24 165.51 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.544 0 C-N-CA 128.911 2.884 . . . . 73.03 115.65 -177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -71.19 104.98 1.62 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 N-CA-C 107.772 -1.664 . . . . 71.14 107.772 157.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? -109.39 26.52 10.54 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.945 1.298 . . . . 71.01 109.481 173.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.58 HD12 ' H ' ' A' ' 86' ' ' ILE . 1.1 mp -76.38 158.08 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 106.273 -1.751 . . . . 73.23 106.273 168.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -84.42 -3.32 58.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.699 0.629 . . . . 53.12 112.699 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -135.25 158.88 43.23 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 125.959 1.704 . . . . 61.44 108.0 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -133.88 11.18 3.97 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.398 1.079 . . . . 44.41 111.552 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 22.3 p-90 -137.52 4.29 2.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.005 2.122 . . . . 74.2 111.441 -176.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.249 1.044 0 C-N-CA 125.735 1.614 . . . . 73.14 109.964 -179.175 . . . . . . . . 0 0 . 1 stop_ save_