data_2n74_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 2n74 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 117.9 -1.048 . . . . 0.0 113.719 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.641 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' B' ' 115' ' ' LEU . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.652 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.652 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.691 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.772 -1.109 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.579 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' A' ' 15' ' ' LEU . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.66 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.66 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.696 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.696 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.582 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.1 m120 -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.583 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.595 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.583 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.1 m120 -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.401 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.582 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.571 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.571 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.607 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.607 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 . . . . . 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m . . . . . 0 N--CA 1.499 1.995 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.542 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.472 ' O ' HG22 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.472 HG22 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.548 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . 0.594 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.536 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.459 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.536 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.506 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.458 ' O ' HG23 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.648 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.648 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.483 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.483 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . 0.455 ' O ' HG23 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.651 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.56 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.651 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG22 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.545 HG22 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . 0.505 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.505 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG22 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.45 ' H ' HG21 ' A' ' 56' ' ' THR . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.686 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.501 2.1 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.553 ' O ' HG22 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.449 ' H ' HG21 ' B' ' 156' ' ' THR . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.553 HG22 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . 0.592 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.592 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.498 1.929 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.497 1.909 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.427 ' O ' HG22 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.426 ' H ' HG22 ' B' ' 156' ' ' THR . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.427 HG22 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 . . . . . 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.533 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.538 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.876 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.876 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 . . . . . 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.538 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.533 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.864 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.864 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.5 2.028 0 CA-C-O 120.638 0.256 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.475 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.565 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.565 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.489 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.446 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 . . . . . 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 120.483 0.183 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.489 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.475 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.622 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.622 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . 0.477 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 117.732 -1.128 . . . . 0.0 113.955 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.635 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.407 ' O ' HG21 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.678 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.662 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.662 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.653 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.678 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.519 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 117.665 -1.159 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.653 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . 0.405 ' O ' HG21 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.674 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.635 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.674 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.51 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.51 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 . . . . . 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.281 -1.343 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.444 ' O ' HG21 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.485 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.426 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.444 HG21 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.212 -1.375 . . . . 0.0 114.19 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . 0.445 ' O ' HG21 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . 0.483 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.424 ' O ' HG23 ' B' ' 158' ' ' THR 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.445 HG21 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.491 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.672 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.564 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.411 ' O ' HG21 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.438 ' O ' HG22 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.677 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.582 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.677 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.666 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.666 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 . . . . . 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.805 -1.093 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.582 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . 0.414 ' O ' HG21 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . 0.432 ' O ' HG22 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.682 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . 0.432 HG22 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.564 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.61 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.682 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.531 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.531 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.529 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.648 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.658 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.564 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.658 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.572 ' O ' HG22 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.572 HG22 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.701 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.701 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.641 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.648 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.571 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.641 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG22 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.575 HG22 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . 0.421 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.505 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.555 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.425 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.591 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.591 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 70.3 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.677 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.677 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.424 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.585 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.585 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.644 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 71.0 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.576 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.644 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.576 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m . . . . . 0 N--CA 1.533 3.719 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.545 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . 0.449 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.449 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 12.4 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.835 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.835 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 . . . . . 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m . . . . . 0 N--CA 1.532 3.669 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.562 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . 0.434 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.545 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . 0.434 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 12.3 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.848 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . 0.848 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 . . . . . 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.969 -1.015 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.477 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.4 m120 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.495 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 11.0 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.543 ' O ' HG21 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.543 HG21 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.518 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 117.955 -1.021 . . . . 0.0 113.615 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' ASN . . . . . 0.495 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.4 m120 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 10.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' ILE . . . . . 0.537 ' O ' HG21 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 158' ' ' THR . . . . . 0.537 HG21 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 163' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 164' ' ' ILE . . . . . 0.456 ' O ' HG23 ' B' ' 164' ' ' ILE . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 167' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.465 0.65 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.13 108.87 20.61 Favored 'General case' 0 C--N 1.372 1.575 0 CA-C-O 122.49 1.138 . . . . 0.0 111.962 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -100.0 -42.72 6.64 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.808 2.443 . . . . 0.0 113.719 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.641 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' B' ' 115' ' ' LEU . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.652 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.652 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.691 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -85.34 -39.06 18.07 Favored 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -45.17 -30.24 1.12 Allowed 'General case' 0 N--CA 1.517 2.916 0 N-CA-C 119.506 3.15 . . . . 0.0 119.506 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.382 2.018 0 C-N-CA 124.06 0.944 . . . . 0.0 112.129 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 3.2 mtt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.557 0.694 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.23 108.32 19.77 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-O 122.452 1.12 . . . . 0.0 111.925 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m -99.71 -42.41 6.87 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 127.663 2.385 . . . . 0.0 113.676 177.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.579 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.407 ' HG ' ' HG ' ' A' ' 15' ' ' LEU . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.66 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.641 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.66 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.696 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.696 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.63 -50.95 8.73 Favored 'General case' 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -35.41 -31.43 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.152 0 N-CA-C 119.687 3.217 . . . . 0.0 119.687 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.131 0 C-N-CA 124.243 1.017 . . . . 0.0 112.363 -176.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.946 0.879 . . . . 0.0 110.711 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.97 90.26 2.57 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.679 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m 16.52 -57.43 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 175.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.582 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.1 m120 -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.583 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.595 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -92.51 -49.47 6.1 Favored 'General case' 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -147.76 134.2 19.69 Favored 'General case' 0 C--N 1.388 2.26 0 C-N-CA 126.748 2.019 . . . . 0.0 107.299 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.371 1.511 0 CA-C-N 122.216 2.28 . . . . 0.0 111.606 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.09 0.948 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.09 90.33 2.57 Favored 'General case' 0 C--N 1.363 1.174 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.613 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m 16.54 -57.09 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.583 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.1 m120 -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.401 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.582 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.571 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.571 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -88.33 -70.47 0.64 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -129.7 133.87 47.31 Favored 'General case' 0 C--N 1.387 2.212 0 C-N-CA 127.389 2.275 . . . . 0.0 108.244 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.376 1.75 0 CA-C-N 122.135 2.243 . . . . 0.0 111.648 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -121.98 156.76 32.75 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 125.068 1.347 . . . . 0.0 110.951 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -86.44 -2.55 58.54 Favored 'General case' 0 C--N 1.385 2.145 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.483 ' O ' HG22 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.483 HG22 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.607 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.607 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -82.69 -48.14 11.22 Favored 'General case' 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -149.42 139.65 22.23 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 127.44 2.296 . . . . 0.0 106.641 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-N 122.536 2.425 . . . . 0.0 111.758 178.062 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.2 156.78 33.02 Favored 'General case' 0 C--N 1.376 1.737 0 C-N-CA 124.901 1.281 . . . . 0.0 110.785 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m -86.47 -2.58 58.58 Favored 'General case' 0 C--N 1.384 2.095 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.542 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.472 ' O ' HG22 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.472 HG22 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -84.02 -68.45 0.71 Allowed 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -132.22 137.65 47.64 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 127.826 2.451 . . . . 0.0 107.48 176.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.495 1.78 0 CA-C-N 122.276 2.307 . . . . 0.0 111.782 178.587 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.751 ' N ' ' HG ' ' A' ' 7' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 119.917 -0.087 . . . . 0.0 110.967 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.32 -3.98 17.87 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 124.697 1.199 . . . . 0.0 112.501 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m -158.85 116.02 2.78 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.751 ' HG ' ' N ' ' A' ' 1' ' ' MET . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.548 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 -87.1 20.33 2.75 Favored 'General case' 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -102.73 -17.14 15.75 Favored 'General case' 0 C--N 1.376 1.756 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.381 1.94 0 CA-C-N 119.106 0.866 . . . . 0.0 112.168 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.759 ' N ' ' HG ' ' B' ' 107' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 119.962 -0.066 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.62 -3.84 17.62 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 124.673 1.189 . . . . 0.0 112.405 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m -158.98 116.68 2.82 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' SER . . . . . 0.759 ' HG ' ' N ' ' B' ' 101' ' ' MET . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . 0.594 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.536 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.459 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.536 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.506 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 -87.38 21.06 2.58 Favored 'General case' 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -103.6 -16.9 15.37 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.382 2.016 0 CA-C-N 119.204 0.911 . . . . 0.0 112.249 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 mtt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 121.476 0.655 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.44 162.08 16.55 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 124.301 1.04 . . . . 0.0 112.17 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m -87.59 5.69 38.17 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.458 ' O ' HG23 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.648 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.648 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.483 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.483 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.37 13.59 11.39 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -98.89 -15.7 19.09 Favored 'General case' 0 C--N 1.373 1.592 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.13 0 C-N-CA 123.98 0.912 . . . . 0.0 111.945 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.1 mtt . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 121.541 0.686 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.87 162.1 16.2 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 124.287 1.035 . . . . 0.0 111.979 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m -88.04 6.32 36.69 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . 0.455 ' O ' HG23 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.651 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.56 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.651 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG22 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.545 HG22 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . 0.505 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.505 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -89.0 14.59 10.24 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -99.32 -15.67 18.73 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.386 2.171 0 C-N-CA 124.137 0.975 . . . . 0.0 112.007 -178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 119.362 -0.352 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.66 107.78 0.05 OUTLIER 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 126.73 2.012 . . . . 0.0 113.032 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m -99.53 -42.7 6.81 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.289 2.236 . . . . 0.0 114.973 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG22 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.45 ' H ' HG21 ' A' ' 56' ' ' THR . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.686 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -89.08 18.01 5.34 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -101.28 -19.84 15.49 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.109 0 C-N-CA 123.988 0.915 . . . . 0.0 111.563 -178.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.6 107.52 0.05 OUTLIER 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 126.742 2.017 . . . . 0.0 112.942 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m -99.41 -41.62 7.33 Favored 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 127.282 2.233 . . . . 0.0 114.901 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.553 ' O ' HG22 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.449 ' H ' HG21 ' B' ' 156' ' ' THR . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.553 HG22 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . 0.592 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.592 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -89.16 18.87 4.64 Favored 'General case' 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -102.35 -19.45 14.98 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.145 0 C-N-CA 124.012 0.925 . . . . 0.0 111.619 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.462 0.649 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.11 112.62 24.9 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 122.39 1.09 . . . . 0.0 112.132 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m -102.21 -44.33 5.46 Favored 'General case' 0 N--CA 1.498 1.929 0 C-N-CA 127.269 2.228 . . . . 0.0 114.625 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.425 HG22 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -93.87 -48.74 6.14 Favored 'General case' 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -147.77 133.33 18.74 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 127.22 2.208 . . . . 0.0 107.256 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 122.296 2.316 . . . . 0.0 112.155 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.525 0.679 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.83 112.36 24.57 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 122.501 1.143 . . . . 0.0 112.089 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m -102.18 -43.14 5.81 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 127.298 2.239 . . . . 0.0 114.586 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.427 ' O ' HG22 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.426 ' H ' HG22 ' B' ' 156' ' ' THR . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.427 HG22 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -91.69 -68.93 0.76 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -130.16 132.86 46.24 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 127.837 2.455 . . . . 0.0 108.223 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 122.278 2.308 . . . . 0.0 112.166 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.612 0.72 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.7 159.31 19.05 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 124.467 1.107 . . . . 0.0 111.208 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m -86.58 4.24 40.98 Favored 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.533 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.538 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.876 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.876 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -107.89 -41.49 4.96 Favored 'General case' 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -144.13 126.09 15.37 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.387 1.903 . . . . 0.0 107.037 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-N 122.212 2.278 . . . . 0.0 112.083 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.575 0.702 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.32 158.9 19.21 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.616 1.167 . . . . 0.0 111.17 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m -86.38 3.99 41.26 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.538 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.533 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.864 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.864 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -95.76 -66.87 0.88 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -129.38 128.34 42.86 Favored 'General case' 0 C--N 1.398 2.708 0 C-N-CA 126.972 2.109 . . . . 0.0 107.754 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.977 0 CA-C-N 122.433 2.378 . . . . 0.0 111.859 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.804 0.811 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.05 -80.15 0.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 124.795 1.238 . . . . 0.0 111.912 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m -133.38 179.5 6.17 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.493 1.917 . . . . 0.0 111.194 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.475 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.565 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.565 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.489 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.446 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.619 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 -78.72 -42.38 28.42 Favored 'General case' 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 64.47 87.0 0.12 Allowed 'General case' 1 C--N 1.428 4.003 0 N-CA-C 105.36 -2.089 . . . . 0.0 105.36 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 118.43 -0.795 . . . . 0.0 111.95 -169.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.729 0.776 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.15 -80.69 0.62 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.888 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m -132.87 179.51 6.13 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 126.577 1.951 . . . . 0.0 111.117 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.489 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.475 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.622 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.622 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . 0.477 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -74.57 -57.12 4.13 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 73.82 88.78 0.09 Allowed 'General case' 0 C--N 1.421 3.701 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.594 -169.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.52 0.676 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.38 110.07 21.12 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.37 1.068 . . . . 0.0 111.535 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m -101.41 -44.63 5.57 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.083 2.153 . . . . 0.0 113.955 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.635 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.407 ' O ' HG21 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.678 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.662 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.662 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.653 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.678 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.519 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.519 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -87.8 -49.96 6.77 Favored 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -148.73 -3.74 0.45 Allowed 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 117.282 -1.342 . . . . 0.0 114.481 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.377 1.787 0 CA-C-N 122.617 2.462 . . . . 0.0 112.163 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.504 0.669 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.18 109.34 20.27 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 122.368 1.08 . . . . 0.0 111.392 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m -100.77 -44.11 5.9 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.962 2.105 . . . . 0.0 113.715 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.653 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . 0.405 ' O ' HG21 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.674 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.65 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.635 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.674 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.51 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.51 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -81.67 -75.91 0.27 Allowed 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -126.3 -3.79 6.79 Favored 'General case' 0 C--N 1.378 1.814 0 N-CA-C 116.266 1.95 . . . . 0.0 116.266 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.376 1.748 0 CA-C-N 123.085 2.675 . . . . 0.0 112.338 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.403 0.62 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.78 112.61 24.41 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 122.358 1.075 . . . . 0.0 112.112 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -101.62 -44.92 5.42 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.977 2.111 . . . . 0.0 114.474 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.444 ' O ' HG21 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.485 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.426 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.444 HG21 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.83 12.08 24.86 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -99.51 -28.15 13.38 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -171.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.383 2.056 0 C-N-CA 124.491 1.117 . . . . 0.0 112.239 -176.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.462 0.648 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.79 112.4 24.06 Favored 'General case' 0 C--N 1.369 1.433 0 CA-C-O 122.321 1.057 . . . . 0.0 111.996 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m -101.47 -44.54 5.58 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.818 2.047 . . . . 0.0 114.19 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . 0.445 ' O ' HG21 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . 0.483 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.424 ' O ' HG23 ' B' ' 158' ' ' THR 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.445 HG21 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.491 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -93.71 12.22 26.33 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -99.49 -28.25 13.33 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -171.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.385 2.143 0 C-N-CA 124.678 1.191 . . . . 0.0 112.415 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.5 2.035 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -101.64 108.05 19.48 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 122.584 1.183 . . . . 0.0 112.214 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -100.21 -47.27 5.01 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 112.693 -2.049 . . . . 0.0 113.672 177.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.564 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.411 ' O ' HG21 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.438 ' O ' HG22 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.677 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.582 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.677 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.666 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.666 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -86.8 13.68 8.44 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -101.39 -13.92 17.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -173.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.378 1.808 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.003 -178.565 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.7 mtt . . . . . 0 N--CA 1.499 1.985 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -100.96 107.55 19.06 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-O 122.651 1.215 . . . . 0.0 112.071 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m -99.75 -46.91 5.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.504 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.582 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . 0.414 ' O ' HG21 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . 0.432 ' O ' HG22 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.682 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . 0.432 HG22 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.564 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.61 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.682 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.531 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.531 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.529 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -87.43 12.51 12.0 Favored 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -100.09 -13.33 19.05 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.378 1.834 0 CA-C-O 118.418 -0.801 . . . . 0.0 112.069 -178.775 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.83 159.69 18.07 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 125.134 1.374 . . . . 0.0 111.496 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m -85.04 3.49 38.43 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.648 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.658 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.564 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.658 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.572 ' O ' HG22 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.572 HG22 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.701 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.701 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -67.83 -40.96 83.7 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 48.58 22.64 0.52 Allowed 'General case' 0 N--CA 1.538 3.944 0 C-N-CA 125.702 1.601 . . . . 0.0 113.379 175.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.371 1.538 0 C-N-CA 125.275 1.43 . . . . 0.0 111.808 -169.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.7 mtt . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.53 159.87 17.7 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 124.97 1.308 . . . . 0.0 111.335 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m -85.21 3.95 36.91 Favored 'General case' 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.641 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.648 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.571 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.641 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG22 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.575 HG22 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . 0.421 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.505 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.555 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.68 -49.04 67.42 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 53.37 21.42 2.35 Favored 'General case' 1 N--CA 1.539 4.006 0 C-N-CA 125.699 1.6 . . . . 0.0 112.787 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.366 1.325 0 C-N-CA 125.34 1.456 . . . . 0.0 111.852 -169.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.808 0.814 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.56 46.11 1.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.636 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m -78.42 -2.37 38.05 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -173.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.425 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.591 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.591 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 70.3 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.677 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.677 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 -92.49 16.58 11.6 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -97.07 -12.89 22.64 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.503 0.721 . . . . 0.0 112.898 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.373 1.606 0 C-N-CA 124.249 1.02 . . . . 0.0 111.976 -179.428 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 121.876 0.846 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.22 45.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.432 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m -78.5 -2.23 37.64 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 -173.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.424 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.585 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.585 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.644 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 71.0 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.576 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.644 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.576 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 -91.25 15.56 11.7 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -96.74 -12.64 23.46 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -173.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.376 1.743 0 C-N-CA 124.316 1.046 . . . . 0.0 112.14 -179.123 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mtt . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 121.401 0.62 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -127.84 121.72 30.81 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.635 1.174 . . . . 0.0 112.539 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m 73.96 -60.44 0.53 Allowed 'General case' 0 N--CA 1.533 3.719 0 C-N-CA 126.853 2.061 . . . . 0.0 116.275 175.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.545 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . 0.449 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.449 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 12.4 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.835 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.835 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 -109.74 -39.53 5.08 Favored 'General case' 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -140.69 115.42 9.59 Favored 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 122.226 2.284 . . . . 0.0 106.915 170.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 118.865 -2.397 . . . . 0.0 112.154 -175.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.374 0.607 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -128.26 121.84 30.27 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.555 1.142 . . . . 0.0 112.582 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m 73.66 -60.15 0.54 Allowed 'General case' 0 N--CA 1.532 3.669 0 C-N-CA 126.793 2.037 . . . . 0.0 116.097 176.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.562 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . 0.434 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.545 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . 0.434 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 12.3 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.848 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . 0.848 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 -111.42 -57.74 2.21 Favored 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -125.57 115.05 19.56 Favored 'General case' 0 N--CA 1.509 2.481 0 CA-C-N 122.897 2.59 . . . . 0.0 108.175 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 118.76 -2.462 . . . . 0.0 111.957 -175.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.41 110.51 21.66 Favored 'General case' 0 C--N 1.375 1.712 0 CA-C-O 122.895 1.331 . . . . 0.0 112.846 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m -102.25 -46.21 4.89 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 112.251 -2.249 . . . . 0.0 113.715 177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.477 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.4 m120 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.495 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 11.0 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.543 ' O ' HG21 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.543 HG21 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.518 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.89 12.19 31.14 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -97.44 -24.56 15.55 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -171.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--N 1.379 1.86 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.022 -177.818 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.5 2.053 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.22 110.24 21.39 Favored 'General case' 0 C--N 1.374 1.665 0 CA-C-O 122.906 1.336 . . . . 0.0 112.728 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m -101.99 -45.81 5.07 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.181 -2.281 . . . . 0.0 113.615 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ASN . . . . . 0.495 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.4 m120 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 10.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' ILE . . . . . 0.537 ' O ' HG21 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' THR . . . . . 0.537 HG21 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' ILE . . . . . 0.456 ' O ' HG23 ' B' ' 164' ' ' ILE . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.24 11.08 37.68 Favored 'General case' 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -96.82 -24.36 15.94 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -171.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.383 2.031 0 C-N-CA 124.082 0.953 . . . . 0.0 112.066 -177.837 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 117.9 -1.048 . . . . 0.0 113.719 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.643 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.586 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.552 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.715 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 61' ' ' GLY . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.772 -1.109 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.586 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.725 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.643 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.567 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.725 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' GLY . . . . . 0.452 ' O ' HG23 ' B' ' 165' ' ' VAL . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.716 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 165' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 161' ' ' GLY . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.716 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 1.0 OUTLIER -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.591 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.4 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 61' ' ' GLY . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 1.0 OUTLIER -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.586 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.586 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' B' ' 128' ' ' GLY . 14.9 m-80 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' B' ' 104' ' ' ASN . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 68' ' ' ILE . 3.3 mt-10 . . . . . 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m . . . . . 0 N--CA 1.499 1.995 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLY . 14.2 m-80 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.543 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.483 ' H ' ' HB3' ' A' ' 4' ' ' ASN . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.469 ' O ' HG23 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.469 HG23 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 165' ' ' VAL . . . . . 0.63 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.63 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.41 HH12 HG23 ' B' ' 168' ' ' ILE . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.581 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.439 HH12 HG23 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 125' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 126' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.468 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.462 ' O ' HG22 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.644 HD21 HD21 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.496 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.6 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 61' ' ' GLY . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' CYS . . . . . 0.452 ' O ' HG22 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.644 HD21 HD21 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.72 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.72 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.527 ' O ' HG23 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.569 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.671 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.685 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.569 HG22 HG12 ' A' ' 11' ' ' VAL . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.501 2.1 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' VAL . . . . . 0.558 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.561 ' O ' HG23 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.561 HG23 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' GLY . . . . . 0.692 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.541 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.692 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 165' ' ' VAL . . . . . 0.558 HG22 HG12 ' B' ' 111' ' ' VAL . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.571 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.498 1.929 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.435 ' HB3' HD11 ' A' ' 36' ' ' LEU . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' A' ' 19' ' ' ARG . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.438 ' O ' HG23 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.497 1.909 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.412 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ARG . . . . . 0.436 ' HB3' HD11 ' B' ' 136' ' ' LEU . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' B' ' 119' ' ' ARG . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.44 ' O ' HG23 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.44 HG23 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 . . . . . 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.448 ' HA ' HG23 ' A' ' 58' ' ' THR . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.541 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.448 HG23 ' HA ' ' A' ' 14' ' ' PHE . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.901 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.901 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 . . . . . 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.541 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' PHE . . . . . 0.453 ' HA ' HG23 ' B' ' 158' ' ' THR . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.453 HG23 ' HA ' ' B' ' 114' ' ' PHE . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.881 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.881 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.5 2.028 0 CA-C-O 120.638 0.256 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.474 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.403 ' HZ2' ' O ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.55 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.55 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 36' ' ' LEU . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 33' ' ' LEU . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.614 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 . . . . . 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 120.483 0.183 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.494 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.575 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 131' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' B' ' 136' ' ' LEU . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 133' ' ' LEU . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.619 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.619 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 117.732 -1.128 . . . . 0.0 113.955 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.631 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.408 ' O ' HG22 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.764 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.764 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.527 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.527 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 117.665 -1.159 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.654 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 113' ' ' CYS . . . . . 0.403 ' O ' HG22 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.75 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.661 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.75 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.522 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.522 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' B' ' 171' ' ' GLU . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' B' ' 168' ' ' ILE . 5.0 mt-10 . . . . . 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.281 -1.343 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.212 -1.375 . . . . 0.0 114.19 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 113' ' ' CYS . . . . . 0.459 ' O ' HG22 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.459 HG22 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.521 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.521 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.672 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.567 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.42 ' O ' HG22 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.756 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' B' ' 168' ' ' ILE . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.756 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.678 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.678 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 . . . . . 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.805 -1.093 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 113' ' ' CYS . . . . . 0.412 ' O ' HG22 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 114' ' ' PHE . . . . . 0.509 ' O ' HG23 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.754 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 131' ' ' PRO . . . . . 0.417 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 134' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.609 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.754 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.545 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.544 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.468 HD11 HG11 ' B' ' 118' ' ' VAL . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.495 HG11 HD11 ' B' ' 115' ' ' LEU . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.574 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.568 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.695 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.544 HG22 HG12 ' A' ' 11' ' ' VAL . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.695 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.667 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 111' ' ' VAL . . . . . 0.545 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.495 HD11 HG11 ' A' ' 18' ' ' VAL . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' VAL . . . . . 0.468 HG11 HD11 ' A' ' 15' ' ' LEU . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.576 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG23 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 161' ' ' GLY . . . . . 0.532 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.506 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.55 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' B' B ' 165' ' ' VAL . . . . . 0.545 HG22 HG12 ' B' ' 111' ' ' VAL . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.421 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.628 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.628 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 39.5 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.672 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.672 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.654 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 116' ' ' TRP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.654 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.656 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 39.2 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.656 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 171' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m . . . . . 0 N--CA 1.533 3.719 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' HA ' HG23 ' A' ' 58' ' ' THR . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TRP . . . . . 0.471 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HD3' HD11 ' B' ' 169' ' ' LEU . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.563 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.471 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 20.7 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 14' ' ' PHE . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.857 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.857 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' HD3' ' B' ' 121' ' ' ARG . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 . . . . . 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m . . . . . 0 N--CA 1.532 3.669 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.563 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 114' ' ' PHE . . . . . 0.533 ' HA ' HG23 ' B' ' 158' ' ' THR . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 116' ' ' TRP . . . . . 0.457 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 121' ' ' ARG . . . . . 0.413 ' HD3' HD11 ' A' ' 69' ' ' LEU . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 140' ' ' GLN . . . . . 0.457 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 20.8 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 114' ' ' PHE . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 164' ' ' ILE . . . . . 0.868 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 168' ' ' ILE . . . . . 0.868 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.423 HD11 ' HD3' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 . . . . . 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.969 -1.015 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.48 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.0 m-80 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 19.9 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.546 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 117.955 -1.021 . . . . 0.0 113.615 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 104' ' ' ASN . . . . . 0.498 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.0 m-80 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 120' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 124' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 128' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 19.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 154' ' ' ILE . . . . . 0.525 ' O ' HG23 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.525 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 163' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 167' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.465 0.65 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.13 108.87 20.61 Favored 'General case' 0 C--N 1.372 1.575 0 CA-C-O 122.49 1.138 . . . . 0.0 111.962 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -100.0 -42.72 6.64 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.808 2.443 . . . . 0.0 113.719 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.643 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.586 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.552 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.715 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 61' ' ' GLY . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -85.34 -39.06 18.07 Favored 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -45.17 -30.24 1.12 Allowed 'General case' 0 N--CA 1.517 2.916 0 N-CA-C 119.506 3.15 . . . . 0.0 119.506 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.382 2.018 0 C-N-CA 124.06 0.944 . . . . 0.0 112.129 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 3.2 mtt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.557 0.694 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.23 108.32 19.77 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-O 122.452 1.12 . . . . 0.0 111.925 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m -99.71 -42.41 6.87 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 127.663 2.385 . . . . 0.0 113.676 177.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.586 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.725 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.643 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.567 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.725 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' GLY . . . . . 0.452 ' O ' HG23 ' B' ' 165' ' ' VAL . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.716 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 165' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 161' ' ' GLY . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.716 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.63 -50.95 8.73 Favored 'General case' 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -35.41 -31.43 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.152 0 N-CA-C 119.687 3.217 . . . . 0.0 119.687 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.131 0 C-N-CA 124.243 1.017 . . . . 0.0 112.363 -176.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.946 0.879 . . . . 0.0 110.711 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.97 90.26 2.57 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.679 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m 16.52 -57.43 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 175.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 1.0 OUTLIER -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.591 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.4 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 61' ' ' GLY . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -92.51 -49.47 6.1 Favored 'General case' 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -147.76 134.2 19.69 Favored 'General case' 0 C--N 1.388 2.26 0 C-N-CA 126.748 2.019 . . . . 0.0 107.299 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.371 1.511 0 CA-C-N 122.216 2.28 . . . . 0.0 111.606 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.09 0.948 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.09 90.33 2.57 Favored 'General case' 0 C--N 1.363 1.174 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.613 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m 16.54 -57.09 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 1.0 OUTLIER -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.586 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.586 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -88.33 -70.47 0.64 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -129.7 133.87 47.31 Favored 'General case' 0 C--N 1.387 2.212 0 C-N-CA 127.389 2.275 . . . . 0.0 108.244 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.376 1.75 0 CA-C-N 122.135 2.243 . . . . 0.0 111.648 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -121.98 156.76 32.75 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 125.068 1.347 . . . . 0.0 110.951 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -86.44 -2.55 58.54 Favored 'General case' 0 C--N 1.385 2.145 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' B' ' 128' ' ' GLY . 14.9 m-80 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' B' ' 104' ' ' ASN . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 68' ' ' ILE . 3.3 mt-10 -82.69 -48.14 11.22 Favored 'General case' 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -149.42 139.65 22.23 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 127.44 2.296 . . . . 0.0 106.641 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-N 122.536 2.425 . . . . 0.0 111.758 178.062 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.2 156.78 33.02 Favored 'General case' 0 C--N 1.376 1.737 0 C-N-CA 124.901 1.281 . . . . 0.0 110.785 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m -86.47 -2.58 58.58 Favored 'General case' 0 C--N 1.384 2.095 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLY . 14.2 m-80 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.543 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.483 ' H ' ' HB3' ' A' ' 4' ' ' ASN . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.469 ' O ' HG23 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.469 HG23 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 165' ' ' VAL . . . . . 0.63 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.63 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -84.02 -68.45 0.71 Allowed 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -132.22 137.65 47.64 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 127.826 2.451 . . . . 0.0 107.48 176.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.495 1.78 0 CA-C-N 122.276 2.307 . . . . 0.0 111.782 178.587 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 119.917 -0.087 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.32 -3.98 17.87 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 124.697 1.199 . . . . 0.0 112.501 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m -158.85 116.02 2.78 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.41 HH12 HG23 ' B' ' 168' ' ' ILE . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.581 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 -87.1 20.33 2.75 Favored 'General case' 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -102.73 -17.14 15.75 Favored 'General case' 0 C--N 1.376 1.756 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.381 1.94 0 CA-C-N 119.106 0.866 . . . . 0.0 112.168 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.748 ' N ' ' HG ' ' B' ' 107' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 119.962 -0.066 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.62 -3.84 17.62 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 124.673 1.189 . . . . 0.0 112.405 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m -158.98 116.68 2.82 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' SER . . . . . 0.748 ' HG ' ' N ' ' B' ' 101' ' ' MET . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.439 HH12 HG23 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 125' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.468 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 -87.38 21.06 2.58 Favored 'General case' 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -103.6 -16.9 15.37 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.382 2.016 0 CA-C-N 119.204 0.911 . . . . 0.0 112.249 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 mtt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 121.476 0.655 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.44 162.08 16.55 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 124.301 1.04 . . . . 0.0 112.17 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m -87.59 5.69 38.17 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.462 ' O ' HG22 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.644 HD21 HD21 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.496 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.6 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 61' ' ' GLY . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.37 13.59 11.39 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -98.89 -15.7 19.09 Favored 'General case' 0 C--N 1.373 1.592 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.13 0 C-N-CA 123.98 0.912 . . . . 0.0 111.945 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.1 mtt . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 121.541 0.686 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.87 162.1 16.2 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 124.287 1.035 . . . . 0.0 111.979 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m -88.04 6.32 36.69 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' CYS . . . . . 0.452 ' O ' HG22 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.644 HD21 HD21 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.72 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.72 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.527 ' O ' HG23 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -89.0 14.59 10.24 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -99.32 -15.67 18.73 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.386 2.171 0 C-N-CA 124.137 0.975 . . . . 0.0 112.007 -178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 119.362 -0.352 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.66 107.78 0.05 OUTLIER 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 126.73 2.012 . . . . 0.0 113.032 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m -99.53 -42.7 6.81 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.289 2.236 . . . . 0.0 114.973 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.569 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.671 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.685 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.569 HG22 HG12 ' A' ' 11' ' ' VAL . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -89.08 18.01 5.34 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -101.28 -19.84 15.49 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.109 0 C-N-CA 123.988 0.915 . . . . 0.0 111.563 -178.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.6 107.52 0.05 OUTLIER 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 126.742 2.017 . . . . 0.0 112.942 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m -99.41 -41.62 7.33 Favored 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 127.282 2.233 . . . . 0.0 114.901 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' VAL . . . . . 0.558 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.561 ' O ' HG23 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.561 HG23 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' GLY . . . . . 0.692 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.541 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.692 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 165' ' ' VAL . . . . . 0.558 HG22 HG12 ' B' ' 111' ' ' VAL . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.571 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -89.16 18.87 4.64 Favored 'General case' 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -102.35 -19.45 14.98 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.145 0 C-N-CA 124.012 0.925 . . . . 0.0 111.619 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.462 0.649 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.11 112.62 24.9 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 122.39 1.09 . . . . 0.0 112.132 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m -102.21 -44.33 5.46 Favored 'General case' 0 N--CA 1.498 1.929 0 C-N-CA 127.269 2.228 . . . . 0.0 114.625 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' HB3' HD11 ' A' ' 36' ' ' LEU . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' A' ' 19' ' ' ARG . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.438 ' O ' HG23 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -93.87 -48.74 6.14 Favored 'General case' 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -147.77 133.33 18.74 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 127.22 2.208 . . . . 0.0 107.256 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 122.296 2.316 . . . . 0.0 112.155 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.525 0.679 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.83 112.36 24.57 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 122.501 1.143 . . . . 0.0 112.089 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m -102.18 -43.14 5.81 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 127.298 2.239 . . . . 0.0 114.586 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.412 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ARG . . . . . 0.436 ' HB3' HD11 ' B' ' 136' ' ' LEU . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' B' ' 119' ' ' ARG . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.44 ' O ' HG23 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.44 HG23 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -91.69 -68.93 0.76 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -130.16 132.86 46.24 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 127.837 2.455 . . . . 0.0 108.223 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 122.278 2.308 . . . . 0.0 112.166 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.612 0.72 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.7 159.31 19.05 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 124.467 1.107 . . . . 0.0 111.208 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m -86.58 4.24 40.98 Favored 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.448 ' HA ' HG23 ' A' ' 58' ' ' THR . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.541 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.448 HG23 ' HA ' ' A' ' 14' ' ' PHE . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.901 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.901 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -107.89 -41.49 4.96 Favored 'General case' 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -144.13 126.09 15.37 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.387 1.903 . . . . 0.0 107.037 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-N 122.212 2.278 . . . . 0.0 112.083 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.575 0.702 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.32 158.9 19.21 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.616 1.167 . . . . 0.0 111.17 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m -86.38 3.99 41.26 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.541 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' PHE . . . . . 0.453 ' HA ' HG23 ' B' ' 158' ' ' THR . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.453 HG23 ' HA ' ' B' ' 114' ' ' PHE . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.881 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.881 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -95.76 -66.87 0.88 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -129.38 128.34 42.86 Favored 'General case' 0 C--N 1.398 2.708 0 C-N-CA 126.972 2.109 . . . . 0.0 107.754 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.977 0 CA-C-N 122.433 2.378 . . . . 0.0 111.859 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.804 0.811 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.05 -80.15 0.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 124.795 1.238 . . . . 0.0 111.912 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m -133.38 179.5 6.17 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.493 1.917 . . . . 0.0 111.194 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.474 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.403 ' HZ2' ' O ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.55 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.55 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 36' ' ' LEU . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 33' ' ' LEU . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.614 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 -78.72 -42.38 28.42 Favored 'General case' 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 64.47 87.0 0.12 Allowed 'General case' 1 C--N 1.428 4.003 0 N-CA-C 105.36 -2.089 . . . . 0.0 105.36 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 118.43 -0.795 . . . . 0.0 111.95 -169.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.729 0.776 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.15 -80.69 0.62 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.888 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m -132.87 179.51 6.13 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 126.577 1.951 . . . . 0.0 111.117 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.494 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.575 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' B' ' 136' ' ' LEU . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 133' ' ' LEU . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.619 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.619 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -74.57 -57.12 4.13 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 73.82 88.78 0.09 Allowed 'General case' 0 C--N 1.421 3.701 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.594 -169.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.52 0.676 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.38 110.07 21.12 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.37 1.068 . . . . 0.0 111.535 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m -101.41 -44.63 5.57 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.083 2.153 . . . . 0.0 113.955 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.631 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.408 ' O ' HG22 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.764 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.764 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.527 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.527 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -87.8 -49.96 6.77 Favored 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -148.73 -3.74 0.45 Allowed 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 117.282 -1.342 . . . . 0.0 114.481 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.377 1.787 0 CA-C-N 122.617 2.462 . . . . 0.0 112.163 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.504 0.669 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.18 109.34 20.27 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 122.368 1.08 . . . . 0.0 111.392 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m -100.77 -44.11 5.9 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.962 2.105 . . . . 0.0 113.715 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.654 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' CYS . . . . . 0.403 ' O ' HG22 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.75 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.661 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.75 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.522 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.522 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' B' ' 171' ' ' GLU . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' B' ' 168' ' ' ILE . 5.0 mt-10 -81.67 -75.91 0.27 Allowed 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -126.3 -3.79 6.79 Favored 'General case' 0 C--N 1.378 1.814 0 N-CA-C 116.266 1.95 . . . . 0.0 116.266 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.376 1.748 0 CA-C-N 123.085 2.675 . . . . 0.0 112.338 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.403 0.62 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.78 112.61 24.41 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 122.358 1.075 . . . . 0.0 112.112 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -101.62 -44.92 5.42 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.977 2.111 . . . . 0.0 114.474 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.83 12.08 24.86 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -99.51 -28.15 13.38 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -171.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.383 2.056 0 C-N-CA 124.491 1.117 . . . . 0.0 112.239 -176.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.462 0.648 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.79 112.4 24.06 Favored 'General case' 0 C--N 1.369 1.433 0 CA-C-O 122.321 1.057 . . . . 0.0 111.996 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m -101.47 -44.54 5.58 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.818 2.047 . . . . 0.0 114.19 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 113' ' ' CYS . . . . . 0.459 ' O ' HG22 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.459 HG22 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.521 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.521 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -93.71 12.22 26.33 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -99.49 -28.25 13.33 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -171.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.385 2.143 0 C-N-CA 124.678 1.191 . . . . 0.0 112.415 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.5 2.035 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -101.64 108.05 19.48 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 122.584 1.183 . . . . 0.0 112.214 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -100.21 -47.27 5.01 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 112.693 -2.049 . . . . 0.0 113.672 177.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.567 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.42 ' O ' HG22 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.756 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' B' ' 168' ' ' ILE . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.756 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.678 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.678 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -86.8 13.68 8.44 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -101.39 -13.92 17.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -173.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.378 1.808 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.003 -178.565 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.7 mtt . . . . . 0 N--CA 1.499 1.985 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -100.96 107.55 19.06 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-O 122.651 1.215 . . . . 0.0 112.071 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m -99.75 -46.91 5.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.504 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' CYS . . . . . 0.412 ' O ' HG22 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' PHE . . . . . 0.509 ' O ' HG23 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.754 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' PRO . . . . . 0.417 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.609 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.754 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.545 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -87.43 12.51 12.0 Favored 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -100.09 -13.33 19.05 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.378 1.834 0 CA-C-O 118.418 -0.801 . . . . 0.0 112.069 -178.775 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.83 159.69 18.07 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 125.134 1.374 . . . . 0.0 111.496 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m -85.04 3.49 38.43 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.544 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD11 HG11 ' B' ' 118' ' ' VAL . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.495 HG11 HD11 ' B' ' 115' ' ' LEU . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.574 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.568 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.695 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.544 HG22 HG12 ' A' ' 11' ' ' VAL . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.695 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -67.83 -40.96 83.7 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 48.58 22.64 0.52 Allowed 'General case' 0 N--CA 1.538 3.944 0 C-N-CA 125.702 1.601 . . . . 0.0 113.379 175.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.371 1.538 0 C-N-CA 125.275 1.43 . . . . 0.0 111.808 -169.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.7 mtt . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.53 159.87 17.7 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 124.97 1.308 . . . . 0.0 111.335 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m -85.21 3.95 36.91 Favored 'General case' 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.667 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' VAL . . . . . 0.545 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.495 HD11 HG11 ' A' ' 18' ' ' VAL . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' VAL . . . . . 0.468 HG11 HD11 ' A' ' 15' ' ' LEU . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.576 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG23 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' GLY . . . . . 0.532 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.506 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.55 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 165' ' ' VAL . . . . . 0.545 HG22 HG12 ' B' ' 111' ' ' VAL . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.68 -49.04 67.42 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 53.37 21.42 2.35 Favored 'General case' 1 N--CA 1.539 4.006 0 C-N-CA 125.699 1.6 . . . . 0.0 112.787 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.366 1.325 0 C-N-CA 125.34 1.456 . . . . 0.0 111.852 -169.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.808 0.814 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.56 46.11 1.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.636 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m -78.42 -2.37 38.05 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -173.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.421 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.628 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.628 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 39.5 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.672 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.672 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 -92.49 16.58 11.6 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -97.07 -12.89 22.64 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.503 0.721 . . . . 0.0 112.898 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.373 1.606 0 C-N-CA 124.249 1.02 . . . . 0.0 111.976 -179.428 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 121.876 0.846 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.22 45.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.432 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m -78.5 -2.23 37.64 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 -173.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.654 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 116' ' ' TRP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.654 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.656 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 39.2 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.656 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 171' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 -91.25 15.56 11.7 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -96.74 -12.64 23.46 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -173.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.376 1.743 0 C-N-CA 124.316 1.046 . . . . 0.0 112.14 -179.123 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mtt . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 121.401 0.62 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -127.84 121.72 30.81 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.635 1.174 . . . . 0.0 112.539 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m 73.96 -60.44 0.53 Allowed 'General case' 0 N--CA 1.533 3.719 0 C-N-CA 126.853 2.061 . . . . 0.0 116.275 175.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' HA ' HG23 ' A' ' 58' ' ' THR . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TRP . . . . . 0.471 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HD3' HD11 ' B' ' 169' ' ' LEU . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.563 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.471 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 20.7 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 14' ' ' PHE . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.857 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.857 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' HD3' ' B' ' 121' ' ' ARG . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 -109.74 -39.53 5.08 Favored 'General case' 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -140.69 115.42 9.59 Favored 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 122.226 2.284 . . . . 0.0 106.915 170.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 118.865 -2.397 . . . . 0.0 112.154 -175.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.374 0.607 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -128.26 121.84 30.27 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.555 1.142 . . . . 0.0 112.582 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m 73.66 -60.15 0.54 Allowed 'General case' 0 N--CA 1.532 3.669 0 C-N-CA 126.793 2.037 . . . . 0.0 116.097 176.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.563 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' PHE . . . . . 0.533 ' HA ' HG23 ' B' ' 158' ' ' THR . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' TRP . . . . . 0.457 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 121' ' ' ARG . . . . . 0.413 ' HD3' HD11 ' A' ' 69' ' ' LEU . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 140' ' ' GLN . . . . . 0.457 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 20.8 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 114' ' ' PHE . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 164' ' ' ILE . . . . . 0.868 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 168' ' ' ILE . . . . . 0.868 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.423 HD11 ' HD3' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 -111.42 -57.74 2.21 Favored 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -125.57 115.05 19.56 Favored 'General case' 0 N--CA 1.509 2.481 0 CA-C-N 122.897 2.59 . . . . 0.0 108.175 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 118.76 -2.462 . . . . 0.0 111.957 -175.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.41 110.51 21.66 Favored 'General case' 0 C--N 1.375 1.712 0 CA-C-O 122.895 1.331 . . . . 0.0 112.846 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m -102.25 -46.21 4.89 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 112.251 -2.249 . . . . 0.0 113.715 177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.48 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.0 m-80 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 19.9 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.546 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.89 12.19 31.14 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -97.44 -24.56 15.55 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -171.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--N 1.379 1.86 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.022 -177.818 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.5 2.053 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.22 110.24 21.39 Favored 'General case' 0 C--N 1.374 1.665 0 CA-C-O 122.906 1.336 . . . . 0.0 112.728 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m -101.99 -45.81 5.07 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.181 -2.281 . . . . 0.0 113.615 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ASN . . . . . 0.498 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.0 m-80 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 19.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 154' ' ' ILE . . . . . 0.525 ' O ' HG23 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.525 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 163' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 167' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.24 11.08 37.68 Favored 'General case' 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -96.82 -24.36 15.94 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -171.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.383 2.031 0 C-N-CA 124.082 0.953 . . . . 0.0 112.066 -177.837 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 117.9 -1.048 . . . . 0.0 113.719 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.643 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.586 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.552 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.715 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 61' ' ' GLY . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.5 2.031 0 CA-C-O 117.772 -1.109 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.586 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.725 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.643 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.567 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.725 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . 0.452 ' O ' HG23 ' B' ' 165' ' ' VAL . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.716 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 161' ' ' GLY . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.716 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.1 m120 -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.591 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.4 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 61' ' ' GLY . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 . . . . . 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.1 m120 -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.586 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.586 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' B' ' 128' ' ' GLY . 12.9 m120 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' B' ' 104' ' ' ASN . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 68' ' ' ILE . 3.3 mt-10 . . . . . 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m . . . . . 0 N--CA 1.499 1.995 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLY . 12.8 m120 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.543 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.483 ' H ' ' HB3' ' A' ' 4' ' ' ASN . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.469 ' O ' HG23 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.469 HG23 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . 0.63 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.63 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.41 HH12 HG23 ' B' ' 168' ' ' ILE . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.581 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.439 HH12 HG23 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.468 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 . . . . . 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.462 ' O ' HG22 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.644 HD21 HD21 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.496 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.6 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 61' ' ' GLY . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . 0.407 HG12 HE21 ' B' ' 110' ' ' GLN . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . 0.407 HE21 HG12 ' B' ' 106' ' ' VAL . 41.2 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . 0.452 ' O ' HG22 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.644 HD21 HD21 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.72 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.72 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.527 ' O ' HG23 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.569 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.671 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.685 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.569 HG22 HG12 ' A' ' 11' ' ' VAL . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.501 2.1 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . 0.558 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.561 ' O ' HG23 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.561 HG23 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . 0.692 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.541 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.692 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . 0.558 HG22 HG12 ' B' ' 111' ' ' VAL . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.571 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 . . . . . 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.498 1.929 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.435 ' HB3' HD11 ' A' ' 36' ' ' LEU . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' A' ' 19' ' ' ARG . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.438 ' O ' HG23 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.497 1.909 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.412 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . 0.436 ' HB3' HD11 ' B' ' 136' ' ' LEU . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' B' ' 119' ' ' ARG . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.44 ' O ' HG23 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.44 HG23 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 . . . . . 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.448 ' HA ' HG23 ' A' ' 58' ' ' THR . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.541 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.448 HG23 ' HA ' ' A' ' 14' ' ' PHE . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.901 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.901 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 . . . . . 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.541 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . 0.453 ' HA ' HG23 ' B' ' 158' ' ' THR . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.453 HG23 ' HA ' ' B' ' 114' ' ' PHE . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.881 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.881 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 . . . . . 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.5 2.028 0 CA-C-O 120.638 0.256 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.474 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.403 ' HZ2' ' O ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.55 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.55 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.411 HE22 HG23 ' B' ' 168' ' ' ILE . 3.0 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 36' ' ' LEU . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 33' ' ' LEU . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.614 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.458 HG23 HE22 ' B' ' 125' ' ' GLN 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 . . . . . 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 120.483 0.183 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.494 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.575 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . 0.458 HE22 HG23 ' A' ' 68' ' ' ILE . 3.1 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' B' ' 136' ' ' LEU . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 133' ' ' LEU . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.619 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.619 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.411 HG23 HE22 ' A' ' 25' ' ' GLN 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.502 2.129 0 CA-C-O 117.732 -1.128 . . . . 0.0 113.955 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.631 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.408 ' O ' HG22 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.764 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.764 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.527 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.527 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 117.665 -1.159 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.654 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . 0.403 ' O ' HG22 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.75 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.661 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.75 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.522 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.522 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' B' ' 171' ' ' GLU . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' B' ' 168' ' ' ILE . 5.0 mt-10 . . . . . 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.281 -1.343 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 117.212 -1.375 . . . . 0.0 114.19 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . 0.459 ' O ' HG22 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.459 HG22 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.521 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.521 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.499 2.005 0 CA-C-O 117.736 -1.126 . . . . 0.0 113.672 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.567 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.42 ' O ' HG22 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.756 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' B' ' 168' ' ' ILE . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.756 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.678 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.678 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 . . . . . 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 117.805 -1.093 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . 0.412 ' O ' HG22 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . 0.509 ' O ' HG23 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.754 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . 0.417 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.609 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.754 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.545 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.544 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.468 HD11 HG11 ' B' ' 118' ' ' VAL . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.495 HG11 HD11 ' B' ' 115' ' ' LEU . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.574 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.568 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.695 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.544 HG22 HG12 ' A' ' 11' ' ' VAL . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.695 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.667 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . 0.545 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.495 HD11 HG11 ' A' ' 18' ' ' VAL . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . 0.468 HG11 HD11 ' A' ' 15' ' ' LEU . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.576 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG23 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . 0.532 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.506 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.55 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . 0.545 HG22 HG12 ' B' ' 111' ' ' VAL . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 . . . . . 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.421 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.628 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.628 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 70.3 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.672 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.672 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.654 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 116' ' ' TRP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.654 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.656 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 71.0 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.656 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 . . . . . 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m . . . . . 0 N--CA 1.533 3.719 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' HA ' HG23 ' A' ' 58' ' ' THR . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . 0.471 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HD3' HD11 ' B' ' 169' ' ' LEU . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.563 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.471 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 12.4 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 14' ' ' PHE . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.857 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.857 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' HD3' ' B' ' 121' ' ' ARG . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 . . . . . 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m . . . . . 0 N--CA 1.532 3.669 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.563 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . 0.533 ' HA ' HG23 ' B' ' 158' ' ' THR . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . 0.457 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . 0.413 ' HD3' HD11 ' A' ' 69' ' ' LEU . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . 0.457 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 12.3 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 114' ' ' PHE . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . 0.868 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . 0.868 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.423 HD11 ' HD3' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 . . . . . 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.969 -1.015 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.48 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.4 m120 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 11.0 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.546 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 117.955 -1.021 . . . . 0.0 113.615 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' ASN . . . . . 0.498 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.4 m120 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 10.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' ILE . . . . . 0.525 ' O ' HG23 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.525 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 163' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 167' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 . . . . . 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.465 0.65 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.13 108.87 20.61 Favored 'General case' 0 C--N 1.372 1.575 0 CA-C-O 122.49 1.138 . . . . 0.0 111.962 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.7 m -100.0 -42.72 6.64 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.808 2.443 . . . . 0.0 113.719 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.643 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 15.6 m-80 -85.5 -13.68 48.31 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 120.134 1.334 . . . . 0.0 114.563 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -89.71 -19.28 24.99 Favored 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 123.946 0.898 . . . . 0.0 108.774 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.7 t -88.23 -37.71 10.81 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.497 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.7 m -68.82 -35.07 76.53 Favored 'General case' 0 C--N 1.39 2.366 0 C-N-CA 124.112 0.965 . . . . 0.0 112.162 174.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.93 -16.26 60.05 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 124.336 1.055 . . . . 0.0 112.215 175.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -88.66 -40.69 13.11 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.67 -38.02 88.14 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.366 1.466 . . . . 0.0 111.855 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.2 t -72.37 -41.05 65.22 Favored 'Isoleucine or valine' 0 C--N 1.379 1.87 0 CA-C-O 117.74 -1.124 . . . . 0.0 110.34 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.87 -30.29 70.87 Favored 'General case' 0 C--N 1.389 2.309 0 CA-C-N 119.654 1.115 . . . . 0.0 112.367 175.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.94 -39.11 83.52 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 124.104 0.962 . . . . 0.0 110.497 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -70.17 -48.87 55.46 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 124.513 1.125 . . . . 0.0 110.342 175.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -63.66 -37.01 85.72 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 124.513 1.125 . . . . 0.0 112.336 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 77.1 t90 -65.09 -34.48 78.52 Favored 'General case' 0 C--N 1.377 1.781 0 CA-C-O 118.162 -0.923 . . . . 0.0 112.045 169.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.0 t60 -75.71 -23.16 56.1 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 119.356 0.98 . . . . 0.0 109.301 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.21 -37.98 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -78.21 -31.29 49.32 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 123.575 0.75 . . . . 0.0 112.678 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.306 0.0 OUTLIER -83.67 -12.08 56.38 Favored 'General case' 0 C--N 1.404 2.971 0 C-N-CA 124.053 0.941 . . . . 0.0 113.135 178.18 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 4.3 mtt180 -88.35 -23.01 23.51 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 128.537 2.735 . . . . 0.0 106.747 173.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.7 -48.38 9.5 Favored 'General case' 0 CA--C 1.574 1.879 0 C-N-CA 126.133 1.773 . . . . 0.0 110.575 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.37 -42.38 92.81 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -72.38 -7.27 48.8 Favored 'General case' 0 N--CA 1.52 3.074 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 178.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -104.73 -8.76 18.61 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 128.833 2.853 . . . . 0.0 109.882 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.278 11.8 mt-10 64.28 46.71 3.41 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 127.844 2.458 . . . . 0.0 112.557 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mt -103.7 123.1 46.39 Favored 'General case' 0 C--O 1.251 1.16 0 CA-C-N 112.104 -2.316 . . . . 0.0 108.658 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.586 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.41 -173.09 23.69 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.461 -172.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.39 -174.19 2.6 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 120.59 2.195 . . . . 0.0 109.238 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.66 -37.71 59.36 Favored Pre-proline 0 CA--C 1.588 2.426 0 N-CA-C 116.748 2.129 . . . . 0.0 116.748 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -61.16 -17.41 52.27 Favored 'Trans proline' 1 C--N 1.455 6.182 0 CA-C-N 123.843 2.408 . . . . 0.0 116.334 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -26.37 65.64 Favored 'General case' 0 C--N 1.395 2.575 0 C-N-CA 123.884 0.874 . . . . 0.0 112.401 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.54 -34.65 35.36 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 127.001 2.12 . . . . 0.0 109.255 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.83 -50.59 72.82 Favored 'General case' 0 N--CA 1.518 2.967 0 C-N-CA 125.992 1.717 . . . . 0.0 111.249 173.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 -62.99 -44.41 96.1 Favored 'General case' 0 C--N 1.398 2.693 0 C-N-CA 127.13 2.172 . . . . 0.0 111.493 177.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.552 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.3 OUTLIER -55.83 -48.6 75.19 Favored 'General case' 0 C--N 1.395 2.567 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 176.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -58.8 -40.63 84.62 Favored 'General case' 0 C--N 1.4 2.797 0 C-N-CA 125.918 1.687 . . . . 0.0 114.572 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.53 -50.07 66.59 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 111.92 -2.4 . . . . 0.0 110.741 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.69 -17.06 42.68 Favored 'General case' 0 C--N 1.385 2.115 0 CA-C-N 113.864 -1.516 . . . . 0.0 113.866 -178.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 87.8 mt-30 -67.28 -40.73 86.18 Favored 'General case' 0 C--N 1.406 3.052 0 CA-C-N 119.571 1.078 . . . . 0.0 110.11 -178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.91 -24.15 59.65 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.011 1.324 . . . . 0.0 112.934 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -78.54 -45.04 22.79 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 112.669 -2.06 . . . . 0.0 110.312 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mt -67.47 -43.48 80.89 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 125.234 1.414 . . . . 0.0 112.978 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.99 -37.86 69.77 Favored 'General case' 0 C--N 1.385 2.122 0 C-N-CA 126.737 2.015 . . . . 0.0 111.718 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.85 -27.02 74.22 Favored Glycine 0 C--N 1.391 3.6 0 CA-C-N 119.91 1.232 . . . . 0.0 113.858 175.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -73.65 -27.8 61.44 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 125.184 1.394 . . . . 0.0 108.338 172.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.27 -37.28 94.3 Favored Glycine 1 C--N 1.402 4.241 0 CA-C-O 119.228 -0.762 . . . . 0.0 114.961 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.9 m -59.49 -48.55 81.21 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.628 1.571 . . . . 0.0 113.437 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.02 -60.26 3.84 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 126.54 1.936 . . . . 0.0 115.05 176.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 1.1 mt -78.2 -12.85 60.03 Favored 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.57 46.49 18.93 Favored Glycine 0 C--N 1.364 2.112 0 N-CA-C 117.511 1.765 . . . . 0.0 117.511 173.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.58 134.42 53.82 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-N 119.78 1.79 . . . . 0.0 109.259 -177.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.39 121.76 16.46 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.3 0.64 . . . . 0.0 109.715 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.252 0.5 OUTLIER -56.05 -40.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.367 0 C-N-CA 126.362 1.865 . . . . 0.0 114.852 -178.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.13 -44.77 87.59 Favored 'General case' 0 N--CA 1.514 2.77 0 CA-C-N 119.267 0.94 . . . . 0.0 112.612 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -71.42 -33.42 69.41 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 123.477 0.711 . . . . 0.0 111.78 176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.16 -35.23 71.57 Favored 'General case' 0 C--N 1.377 1.774 0 O-C-N 124.206 0.941 . . . . 0.0 111.031 175.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.92 -22.72 66.96 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 123.499 1.619 . . . . 0.0 110.452 175.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . 0.321 76.8 mtt180 -94.22 -44.34 8.02 Favored 'General case' 0 C--N 1.393 2.493 0 CA-C-N 109.34 -3.573 . . . . 0.0 115.196 -171.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -88.41 -15.59 35.09 Favored 'General case' 0 C--N 1.424 3.829 1 CA-C-N 127.629 4.74 . . . . 0.0 110.007 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -65.55 -35.05 90.72 Favored Glycine 1 C--N 1.407 4.516 0 CA-C-O 117.092 -1.949 . . . . 0.0 110.956 170.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -47.85 -48.65 30.87 Favored 'General case' 0 C--N 1.393 2.471 0 CA-C-N 118.328 1.064 . . . . 0.0 111.42 168.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 53.2 mt-30 -65.46 -36.25 83.34 Favored 'General case' 0 C--N 1.396 2.624 0 C-N-CA 124.665 1.186 . . . . 0.0 111.676 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.715 ' O ' HG12 ' A' ' 68' ' ' ILE 0.346 0.6 OUTLIER -75.8 -15.23 15.39 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.902 0 C-N-CA 126.975 2.11 . . . . 0.0 113.596 179.66 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 61' ' ' GLY . 87.6 t -93.77 -56.71 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.444 0 C-N-CA 125.276 1.43 . . . . 0.0 108.032 177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.71 -70.75 0.09 Allowed 'General case' 0 C--N 1.376 1.733 0 O-C-N 126.544 2.402 . . . . 0.0 109.696 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 94.3 mtt180 -53.65 -38.32 63.99 Favored 'General case' 0 C--N 1.394 2.532 0 CA-C-O 114.661 -2.59 . . . . 0.0 117.512 172.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 64' ' ' ILE 0.33 1.0 OUTLIER -66.92 -17.83 23.29 Favored 'Isoleucine or valine' 1 N--CA 1.548 4.468 0 CA-C-N 123.809 3.004 . . . . 0.0 114.784 178.366 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -90.82 -30.12 17.17 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -82.06 -13.67 56.97 Favored 'General case' 0 N--CA 1.522 3.131 0 CA-C-O 122.961 1.363 . . . . 0.0 111.258 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -85.34 -39.06 18.07 Favored 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 110.842 -2.89 . . . . 0.0 112.742 177.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -45.17 -30.24 1.12 Allowed 'General case' 0 N--CA 1.517 2.916 0 N-CA-C 119.506 3.15 . . . . 0.0 119.506 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.382 2.018 0 C-N-CA 124.06 0.944 . . . . 0.0 112.129 -176.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 3.2 mtt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.557 0.694 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -105.23 108.32 19.77 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-O 122.452 1.12 . . . . 0.0 111.925 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 38.1 m -99.71 -42.41 6.87 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 127.663 2.385 . . . . 0.0 113.676 177.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.586 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 17.2 m-80 -86.25 -10.1 55.23 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -94.22 -16.4 23.69 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 24.8 t -91.1 -38.04 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.4 m -68.89 -35.24 76.63 Favored 'General case' 0 C--N 1.391 2.399 0 C-N-CA 124.113 0.965 . . . . 0.0 112.115 174.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.68 -12.14 59.95 Favored 'General case' 0 C--N 1.399 2.752 0 CA-C-N 119.42 1.009 . . . . 0.0 112.35 175.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -92.11 -40.54 10.99 Favored 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -65.43 -39.0 91.57 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.441 1.496 . . . . 0.0 111.824 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.8 t -71.98 -41.1 68.56 Favored 'Isoleucine or valine' 0 C--N 1.38 1.92 0 CA-C-O 117.598 -1.191 . . . . 0.0 110.078 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.66 -29.59 70.18 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.677 1.126 . . . . 0.0 112.3 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.9 m -68.33 -39.52 81.91 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 124.128 0.971 . . . . 0.0 110.691 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -70.19 -49.08 53.97 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 124.67 1.188 . . . . 0.0 110.399 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 mp -63.34 -36.68 84.51 Favored 'General case' 0 C--N 1.378 1.838 0 C-N-CA 124.48 1.112 . . . . 0.0 112.292 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.725 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 77.5 t90 -65.32 -34.49 78.45 Favored 'General case' 0 CA--C 1.573 1.843 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.006 169.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -75.81 -24.26 55.89 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 119.341 0.973 . . . . 0.0 109.458 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.19 -38.06 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 174.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -77.97 -30.64 50.4 Favored 'General case' 0 CA--C 1.583 2.214 0 C-N-CA 123.5 0.72 . . . . 0.0 112.684 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -86.28 -6.94 58.85 Favored 'General case' 0 C--N 1.408 3.121 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -92.41 -23.47 19.18 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 129.149 2.98 . . . . 0.0 106.451 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.65 -47.9 10.02 Favored 'General case' 0 CA--C 1.571 1.784 0 C-N-CA 126.219 1.808 . . . . 0.0 110.422 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.57 -42.13 92.15 Favored 'General case' 0 CA--C 1.58 2.126 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.68 52.08 Favored 'General case' 0 N--CA 1.518 2.944 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -104.41 -8.41 19.18 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 128.718 2.807 . . . . 0.0 109.842 176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 63.99 47.26 3.47 Favored 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 127.969 2.508 . . . . 0.0 112.375 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.88 122.22 44.71 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 111.904 -2.407 . . . . 0.0 108.478 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.643 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 102.02 -174.57 24.39 Favored Glycine 0 C--O 1.247 0.931 0 CA-C-N 111.924 -2.398 . . . . 0.0 108.681 -173.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.24 -174.99 2.89 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 120.43 2.115 . . . . 0.0 109.288 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.85 -37.62 57.97 Favored Pre-proline 0 CA--C 1.589 2.47 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -61.72 -15.27 41.13 Favored 'Trans proline' 1 C--N 1.457 6.252 0 CA-C-N 123.913 2.433 . . . . 0.0 116.36 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -25.78 63.77 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 123.852 0.861 . . . . 0.0 112.252 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.06 -35.05 32.26 Favored 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 127.045 2.138 . . . . 0.0 109.283 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.58 -50.85 71.86 Favored 'General case' 0 N--CA 1.522 3.141 0 C-N-CA 126.254 1.822 . . . . 0.0 111.34 172.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -62.67 -44.03 97.28 Favored 'General case' 0 C--N 1.396 2.596 0 C-N-CA 127.118 2.167 . . . . 0.0 111.485 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.567 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.3 OUTLIER -56.11 -49.05 74.98 Favored 'General case' 0 C--N 1.392 2.456 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 176.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -58.8 -41.0 85.73 Favored 'General case' 0 C--N 1.402 2.854 0 C-N-CA 126.038 1.735 . . . . 0.0 114.683 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.874 -2.421 . . . . 0.0 110.729 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -16.6 44.56 Favored 'General case' 0 C--N 1.383 2.03 0 CA-C-N 113.733 -1.576 . . . . 0.0 113.805 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.725 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 87.7 mt-30 -67.56 -41.1 84.75 Favored 'General case' 0 C--N 1.405 3.001 0 CA-C-N 119.466 1.03 . . . . 0.0 110.223 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -74.04 -24.61 59.56 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 125.341 1.456 . . . . 0.0 113.009 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.02 -44.97 24.99 Favored 'General case' 0 C--N 1.389 2.326 0 CA-C-N 112.39 -2.187 . . . . 0.0 110.315 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.78 -42.78 81.11 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 125.095 1.358 . . . . 0.0 113.03 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -72.32 -38.1 68.74 Favored 'General case' 0 C--N 1.387 2.199 0 C-N-CA 126.815 2.046 . . . . 0.0 111.988 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.38 -26.55 74.46 Favored Glycine 0 C--N 1.393 3.744 0 CA-C-N 120.044 1.293 . . . . 0.0 113.866 174.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -73.18 -27.71 61.79 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.265 1.426 . . . . 0.0 108.213 172.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.89 -37.28 94.1 Favored Glycine 1 C--N 1.403 4.26 0 CA-C-O 119.17 -0.795 . . . . 0.0 114.954 173.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.2 m -59.25 -49.01 79.48 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.71 1.604 . . . . 0.0 113.358 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -69.85 0.11 Allowed 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 127.449 2.3 . . . . 0.0 114.067 175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 1.2 mt -70.95 -14.35 62.34 Favored 'General case' 0 N--CA 1.514 2.768 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.19 48.21 15.73 Favored Glycine 0 C--N 1.365 2.16 0 N-CA-C 117.76 1.864 . . . . 0.0 117.76 173.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.25 135.14 53.19 Favored 'General case' 0 C--O 1.256 1.445 0 CA-C-N 119.363 1.581 . . . . 0.0 109.334 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.52 122.12 17.8 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.086 0.554 . . . . 0.0 109.758 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -55.34 -41.15 60.49 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.556 0 C-N-CA 126.438 1.895 . . . . 0.0 115.125 -178.262 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -65.33 -45.35 84.61 Favored 'General case' 0 N--CA 1.516 2.851 0 CA-C-N 118.863 0.756 . . . . 0.0 112.875 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -70.09 -33.39 71.83 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 123.135 0.574 . . . . 0.0 111.658 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.81 -32.66 69.8 Favored 'General case' 0 C--N 1.376 1.741 0 O-C-N 124.422 1.076 . . . . 0.0 111.137 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.48 -17.31 63.74 Favored 'General case' 0 CA--C 1.605 3.095 0 C-N-CA 124.667 1.187 . . . . 0.0 113.578 175.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -106.05 -45.25 4.39 Favored 'General case' 0 N--CA 1.523 3.18 0 CA-C-N 112.192 -2.277 . . . . 0.0 112.064 -171.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.29 99.16 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 126.273 1.829 . . . . 0.0 109.67 170.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . 0.452 ' O ' HG23 ' B' ' 165' ' ' VAL . . . -71.4 -33.07 64.47 Favored Glycine 1 C--N 1.4 4.094 0 CA-C-O 116.883 -2.065 . . . . 0.0 114.12 172.555 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -46.87 -48.06 21.18 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 119.12 1.46 . . . . 0.0 112.29 171.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.7 mt-30 -66.79 -35.88 81.11 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.245 1.418 . . . . 0.0 111.297 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.716 ' O ' HG12 ' B' ' 168' ' ' ILE 0.295 0.5 OUTLIER -79.8 -2.04 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.099 0 C-N-CA 125.976 1.711 . . . . 0.0 114.227 -179.566 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 161' ' ' GLY . 87.8 t -106.86 -54.63 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.526 3.369 0 C-N-CA 125.766 1.626 . . . . 0.0 106.811 176.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.39 -78.86 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.484 0 O-C-N 126.805 2.565 . . . . 0.0 107.705 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 94.6 mtt180 -48.2 -38.44 18.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 114.408 -2.711 . . . . 0.0 117.252 173.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.716 HG12 ' O ' ' B' ' 164' ' ' ILE 0.297 1.0 OUTLIER -69.63 -10.3 13.39 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.536 0 CA-C-N 124.724 3.42 . . . . 0.0 115.272 178.52 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.01 -28.18 13.9 Favored 'General case' 0 C--N 1.383 2.048 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -83.14 -13.08 56.3 Favored 'General case' 0 N--CA 1.518 2.969 0 CA-C-O 123.201 1.477 . . . . 0.0 111.128 174.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.63 -50.95 8.73 Favored 'General case' 0 N--CA 1.506 2.326 0 CA-C-N 110.614 -2.994 . . . . 0.0 111.829 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -35.41 -31.43 0.02 OUTLIER 'General case' 0 N--CA 1.522 3.152 0 N-CA-C 119.687 3.217 . . . . 0.0 119.687 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.131 0 C-N-CA 124.243 1.017 . . . . 0.0 112.363 -176.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 121.946 0.879 . . . . 0.0 110.711 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.97 90.26 2.57 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.679 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 m 16.52 -57.43 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.216 0 N-CA-C 120.601 3.556 . . . . 0.0 120.601 175.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.1 m120 -78.78 -17.42 55.79 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 120.941 1.701 . . . . 0.0 114.324 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.0 m -87.92 -20.87 25.36 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 124.919 1.288 . . . . 0.0 108.91 178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.2 t -87.65 -35.16 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.6 m -70.1 -33.45 71.88 Favored 'General case' 0 C--N 1.389 2.324 0 C-N-CA 123.924 0.89 . . . . 0.0 111.485 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -16.82 60.95 Favored 'General case' 0 C--N 1.397 2.639 0 C-N-CA 124.328 1.051 . . . . 0.0 111.862 175.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.8 -42.02 12.16 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 118.484 -0.769 . . . . 0.0 109.161 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.6 -40.18 92.38 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 124.866 1.267 . . . . 0.0 112.26 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -72.19 -39.94 65.4 Favored 'Isoleucine or valine' 0 C--N 1.38 1.914 0 C-N-CA 124.899 1.28 . . . . 0.0 110.642 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.5 OUTLIER -66.38 -29.08 69.17 Favored 'General case' 0 C--N 1.386 2.177 0 CA-C-N 119.106 0.866 . . . . 0.0 111.563 173.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.2 m -66.81 -38.83 87.23 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.238 1.015 . . . . 0.0 110.656 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -67.98 -49.23 62.9 Favored 'General case' 0 C--N 1.383 2.047 0 C-N-CA 124.884 1.274 . . . . 0.0 110.2 175.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.27 -23.86 64.82 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.588 1.155 . . . . 0.0 112.745 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -80.28 -29.27 38.26 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.911 174.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -82.43 -23.36 34.86 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 176.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -73.24 -39.88 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.124 0 O-C-N 125.332 1.645 . . . . 0.0 107.901 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -75.59 -28.24 58.85 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 123.699 0.8 . . . . 0.0 112.182 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -85.81 -12.27 51.32 Favored 'General case' 0 C--N 1.393 2.457 0 C-N-CA 123.538 0.735 . . . . 0.0 112.793 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -86.4 -21.59 27.06 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 127.943 2.497 . . . . 0.0 106.413 174.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.56 -47.19 10.11 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 126.144 1.778 . . . . 0.0 110.606 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.73 -43.31 84.54 Favored 'General case' 0 CA--C 1.575 1.929 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.72 -7.26 46.97 Favored 'General case' 0 N--CA 1.519 2.98 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -105.66 -9.07 17.54 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 128.631 2.772 . . . . 0.0 110.153 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.259 11.1 mt-10 64.02 55.83 1.5 Allowed 'General case' 0 N--CA 1.519 2.994 0 C-N-CA 127.89 2.476 . . . . 0.0 112.845 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.03 124.07 50.14 Favored 'General case' 0 C--O 1.254 1.333 0 CA-C-N 112.483 -2.144 . . . . 0.0 109.816 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.19 -167.73 19.54 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 112.704 -2.044 . . . . 0.0 108.356 -173.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 119.9 1.85 . . . . 0.0 108.887 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.08 -37.76 60.8 Favored Pre-proline 0 CA--C 1.591 2.528 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.65 -17.12 52.71 Favored 'Trans proline' 1 C--N 1.458 6.314 0 CA-C-N 123.833 2.405 . . . . 0.0 116.435 -178.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -66.52 -27.74 68.0 Favored 'General case' 0 C--N 1.394 2.522 0 C-N-CA 123.667 0.787 . . . . 0.0 112.005 177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.69 -34.63 40.05 Favored 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.208 2.203 . . . . 0.0 109.584 175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.23 -50.73 72.5 Favored 'General case' 0 N--CA 1.52 3.067 0 C-N-CA 125.934 1.694 . . . . 0.0 111.757 172.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -61.95 -46.98 86.94 Favored 'General case' 0 C--N 1.398 2.697 0 C-N-CA 127.133 2.173 . . . . 0.0 111.477 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.1 -43.46 74.01 Favored 'General case' 0 C--N 1.388 2.251 0 N-CA-C 115.999 1.852 . . . . 0.0 115.999 177.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.9 40.63 Favored 'General case' 0 C--N 1.393 2.458 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -176.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -58.2 -47.73 82.53 Favored 'General case' 0 C--N 1.405 2.995 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -16.64 57.5 Favored 'General case' 0 C--N 1.388 2.24 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.974 -177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.93 -41.72 86.55 Favored 'General case' 0 C--N 1.404 2.94 0 CA-C-N 118.397 0.544 . . . . 0.0 110.119 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -72.26 -21.65 61.34 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.406 1.482 . . . . 0.0 112.29 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -81.84 -44.68 16.58 Favored 'General case' 0 C--N 1.387 2.215 0 CA-C-N 112.467 -2.151 . . . . 0.0 110.509 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.98 77.65 Favored 'General case' 0 C--N 1.393 2.476 0 C-N-CA 125.142 1.377 . . . . 0.0 113.128 177.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.18 68.67 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 126.345 1.858 . . . . 0.0 111.5 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.68 -27.55 73.59 Favored Glycine 0 C--N 1.391 3.631 0 CA-C-N 119.79 1.177 . . . . 0.0 113.709 174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.84 -28.34 62.47 Favored 'General case' 0 C--N 1.385 2.13 0 C-N-CA 125.263 1.425 . . . . 0.0 109.074 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.28 94.44 Favored Glycine 1 C--N 1.398 4.02 0 CA-C-O 119.283 -0.732 . . . . 0.0 114.815 173.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.7 m -59.07 -49.33 78.31 Favored 'General case' 0 C--N 1.383 2.062 0 C-N-CA 125.534 1.533 . . . . 0.0 112.89 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -60.73 3.15 Favored 'General case' 0 C--N 1.395 2.586 0 C-N-CA 126.592 1.957 . . . . 0.0 114.967 177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mt -77.48 -13.51 59.9 Favored 'General case' 0 N--CA 1.513 2.701 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.06 4.13 87.08 Favored Glycine 0 C--N 1.359 1.833 0 N-CA-C 116.796 1.479 . . . . 0.0 116.796 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -88.48 128.76 35.55 Favored 'General case' 0 C--O 1.257 1.452 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.62 123.3 19.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.076 0.95 . . . . 0.0 109.022 175.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.591 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -53.7 -49.53 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.153 0 C-N-CA 126.183 1.793 . . . . 0.0 114.491 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.21 -45.36 94.91 Favored 'General case' 0 N--CA 1.517 2.881 0 C-N-CA 124.188 0.995 . . . . 0.0 113.168 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t -67.71 -32.61 73.36 Favored 'General case' 0 CA--C 1.575 1.915 0 CA-C-O 119.224 -0.417 . . . . 0.0 110.61 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.88 -31.27 63.06 Favored 'General case' 0 C--N 1.377 1.795 0 O-C-N 124.772 1.295 . . . . 0.0 112.1 176.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.591 HG23 ' O ' ' A' ' 54' ' ' ILE . 54.6 p -65.54 -18.76 65.56 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.668 1.223 . . . . 0.0 112.622 176.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -100.61 -45.04 5.64 Favored 'General case' 0 C--N 1.397 2.656 0 CA-C-N 110.791 -2.913 . . . . 0.0 111.199 -174.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.48 -47.35 86.53 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 126.933 2.093 . . . . 0.0 109.849 173.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.4 ' O ' HG23 ' A' ' 65' ' ' VAL . . . -72.25 -32.93 62.21 Favored Glycine 0 C--N 1.388 3.422 0 CA-C-O 116.875 -2.07 . . . . 0.0 114.097 173.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.35 -50.54 21.89 Favored 'General case' 0 N--CA 1.515 2.784 0 CA-C-N 119.097 1.449 . . . . 0.0 112.58 171.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -66.58 -36.35 82.43 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.935 1.694 . . . . 0.0 112.161 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.25 53.8 mt -62.88 -61.46 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.119 0 CA-C-O 116.074 -1.917 . . . . 0.0 109.328 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 61' ' ' GLY . 22.3 t -49.59 -50.01 18.11 Favored 'Isoleucine or valine' 1 N--CA 1.54 4.058 0 C-N-CA 125.768 1.627 . . . . 0.0 112.536 178.057 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -57.24 -71.99 0.09 Allowed 'General case' 0 CA--C 1.564 1.496 0 O-C-N 125.844 1.965 . . . . 0.0 111.016 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.29 -39.27 69.66 Favored 'General case' 0 N--CA 1.508 2.454 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 173.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.25 1.6 pt -66.34 -17.43 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.533 3.725 0 CA-C-N 122.281 2.31 . . . . 0.0 114.3 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -91.87 -27.16 18.11 Favored 'General case' 0 C--N 1.38 1.907 0 O-C-N 123.703 0.627 . . . . 0.0 111.39 -179.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -83.82 -11.37 57.12 Favored 'General case' 0 CA--C 1.594 2.658 0 CA-C-O 123.028 1.394 . . . . 0.0 111.098 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -92.51 -49.47 6.1 Favored 'General case' 0 N--CA 1.51 2.548 0 CA-C-N 110.714 -2.948 . . . . 0.0 113.329 178.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -147.76 134.2 19.69 Favored 'General case' 0 C--N 1.388 2.26 0 C-N-CA 126.748 2.019 . . . . 0.0 107.299 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.371 1.511 0 CA-C-N 122.216 2.28 . . . . 0.0 111.606 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.09 0.948 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.09 90.33 2.57 Favored 'General case' 0 C--N 1.363 1.174 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.613 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 3.1 m 16.54 -57.09 0.0 OUTLIER 'General case' 1 N--CA 1.543 4.225 0 N-CA-C 120.465 3.505 . . . . 0.0 120.465 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.1 m120 -79.33 -16.9 55.59 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 120.859 1.663 . . . . 0.0 114.19 -177.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.0 m -88.91 -19.42 25.83 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 124.927 1.291 . . . . 0.0 108.988 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.09 -34.99 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 65.8 m -70.13 -33.47 71.86 Favored 'General case' 0 C--N 1.39 2.33 0 C-N-CA 123.926 0.89 . . . . 0.0 111.428 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.32 -13.59 60.43 Favored 'General case' 0 C--N 1.4 2.788 0 CA-C-N 119.387 0.994 . . . . 0.0 112.185 175.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -91.59 -41.85 10.54 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 118.48 -0.771 . . . . 0.0 108.933 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -65.57 -40.32 92.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 124.773 1.229 . . . . 0.0 112.083 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -72.21 -39.99 65.25 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 C-N-CA 124.809 1.244 . . . . 0.0 110.685 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.5 OUTLIER -66.28 -28.87 69.04 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 119.092 0.86 . . . . 0.0 111.693 173.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.02 -38.76 86.51 Favored 'General case' 0 C--N 1.391 2.392 0 C-N-CA 124.254 1.022 . . . . 0.0 110.685 174.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -68.1 -49.22 62.54 Favored 'General case' 0 C--N 1.383 2.031 0 C-N-CA 124.831 1.252 . . . . 0.0 110.188 175.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.23 -23.72 64.84 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 124.529 1.132 . . . . 0.0 112.78 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -80.39 -29.14 37.79 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-N 113.991 -1.459 . . . . 0.0 110.904 174.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -82.56 -23.77 34.34 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.69 -39.74 60.81 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.063 0 O-C-N 125.378 1.674 . . . . 0.0 107.792 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -75.72 -28.02 58.41 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 123.664 0.786 . . . . 0.0 112.044 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -88.82 -4.94 58.36 Favored 'General case' 0 C--N 1.397 2.652 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 16.8 mtt180 -92.23 -21.54 20.29 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 128.559 2.744 . . . . 0.0 106.032 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -85.94 -47.19 9.86 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 125.985 1.714 . . . . 0.0 110.557 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.84 -43.15 84.44 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.1 -6.68 44.21 Favored 'General case' 0 N--CA 1.519 2.979 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -106.13 -9.03 17.13 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 128.72 2.808 . . . . 0.0 110.23 176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 11.2 mt-10 64.06 56.11 1.45 Allowed 'General case' 0 N--CA 1.519 3.023 0 C-N-CA 127.826 2.45 . . . . 0.0 112.71 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.5 mt -109.33 124.0 50.23 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.534 -2.121 . . . . 0.0 109.752 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.17 -167.44 19.38 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 112.73 -2.032 . . . . 0.0 108.312 -173.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.25 -174.23 2.56 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 119.896 1.848 . . . . 0.0 108.885 176.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -37.83 61.7 Favored Pre-proline 0 CA--C 1.59 2.498 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.48 -15.03 42.92 Favored 'Trans proline' 1 C--N 1.459 6.347 0 CA-C-N 123.883 2.423 . . . . 0.0 116.472 -178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -67.74 -27.48 66.82 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 123.603 0.761 . . . . 0.0 111.917 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.98 -34.46 38.57 Favored 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.254 2.222 . . . . 0.0 109.554 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.39 -50.72 72.49 Favored 'General case' 0 N--CA 1.519 3.019 0 C-N-CA 125.934 1.694 . . . . 0.0 111.732 172.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -62.09 -46.83 87.36 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 127.11 2.164 . . . . 0.0 111.506 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -43.35 74.77 Favored 'General case' 0 C--N 1.389 2.288 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 177.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -60.0 -54.93 40.29 Favored 'General case' 0 C--N 1.392 2.421 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 34.9 mtt180 -58.11 -47.75 82.28 Favored 'General case' 0 C--N 1.405 3.008 0 N-CA-C 115.041 1.496 . . . . 0.0 115.041 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.81 -15.57 58.23 Favored 'General case' 0 C--N 1.386 2.195 0 CA-C-N 114.264 -1.334 . . . . 0.0 112.968 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -67.58 -41.73 83.65 Favored 'General case' 0 C--N 1.402 2.876 0 CA-C-N 118.403 0.547 . . . . 0.0 110.033 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -72.27 -21.56 61.35 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 125.434 1.493 . . . . 0.0 112.336 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -81.94 -44.68 16.43 Favored 'General case' 0 C--N 1.387 2.21 0 CA-C-N 112.372 -2.195 . . . . 0.0 110.495 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -45.06 77.4 Favored 'General case' 0 C--N 1.394 2.512 0 C-N-CA 125.091 1.356 . . . . 0.0 113.028 177.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.34 -38.19 68.68 Favored 'General case' 0 C--N 1.38 1.902 0 C-N-CA 126.43 1.892 . . . . 0.0 111.496 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.76 -27.56 73.6 Favored Glycine 0 C--N 1.391 3.599 0 CA-C-N 119.847 1.203 . . . . 0.0 113.618 174.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -72.65 -28.35 62.68 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 125.202 1.401 . . . . 0.0 108.933 172.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.14 -37.24 94.28 Favored Glycine 0 C--N 1.397 3.929 0 CA-C-O 119.001 -0.889 . . . . 0.0 114.789 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.9 m -58.89 -49.18 78.73 Favored 'General case' 0 N--CA 1.502 2.14 0 C-N-CA 125.611 1.564 . . . . 0.0 112.726 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -70.28 0.1 Allowed 'General case' 0 C--N 1.393 2.476 0 C-N-CA 127.47 2.308 . . . . 0.0 113.945 176.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.1 mt -70.48 -16.11 62.88 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 89.82 -5.75 83.26 Favored Glycine 0 C--N 1.364 2.127 0 N-CA-C 116.949 1.54 . . . . 0.0 116.949 173.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -77.41 128.38 34.14 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.36 123.7 20.71 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.759 0.824 . . . . 0.0 108.981 174.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.586 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -53.55 -49.96 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 126.194 1.798 . . . . 0.0 114.588 -177.772 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -60.97 -45.54 94.35 Favored 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 124.178 0.991 . . . . 0.0 113.223 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.3 t -67.3 -32.31 73.2 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.56 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.52 -30.37 61.75 Favored 'General case' 0 C--N 1.376 1.758 0 O-C-N 124.796 1.31 . . . . 0.0 111.947 175.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.586 HG23 ' O ' ' B' ' 154' ' ' ILE . 55.6 p -67.87 -11.45 58.66 Favored 'General case' 0 C--N 1.411 3.247 0 CA-C-N 119.642 1.11 . . . . 0.0 113.109 176.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -110.79 -42.44 4.02 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 111.441 -2.618 . . . . 0.0 110.73 -173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.59 84.98 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.63 1.972 . . . . 0.0 109.378 171.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.19 -33.22 62.15 Favored Glycine 0 C--N 1.389 3.488 0 CA-C-O 116.843 -2.087 . . . . 0.0 114.118 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.27 -50.4 21.55 Favored 'General case' 0 N--CA 1.515 2.797 0 CA-C-N 119.256 1.528 . . . . 0.0 112.609 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -66.45 -36.31 82.45 Favored 'General case' 0 C--N 1.389 2.309 0 C-N-CA 125.918 1.687 . . . . 0.0 112.174 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.25 54.5 mt -63.19 -61.85 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.19 0 CA-C-O 115.98 -1.962 . . . . 0.0 109.303 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 23.2 t -48.98 -50.05 14.82 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.139 0 C-N-CA 125.858 1.663 . . . . 0.0 112.207 178.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -53.89 -81.92 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 O-C-N 126.222 2.201 . . . . 0.0 109.495 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -48.05 -39.42 19.92 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 1.5 pt -69.05 -9.2 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.578 0 CA-C-N 122.888 2.586 . . . . 0.0 114.805 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.01 -26.24 14.04 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 123.358 0.411 . . . . 0.0 110.727 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -84.25 -10.23 57.84 Favored 'General case' 0 N--CA 1.515 2.793 0 CA-C-O 123.402 1.573 . . . . 0.0 111.01 174.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -88.33 -70.47 0.64 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 109.993 -3.276 . . . . 0.0 110.493 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -129.7 133.87 47.31 Favored 'General case' 0 C--N 1.387 2.212 0 C-N-CA 127.389 2.275 . . . . 0.0 108.244 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.376 1.75 0 CA-C-N 122.135 2.243 . . . . 0.0 111.648 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -121.98 156.76 32.75 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 125.068 1.347 . . . . 0.0 110.951 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -86.44 -2.55 58.54 Favored 'General case' 0 C--N 1.385 2.145 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' B' ' 128' ' ' GLY . 12.9 m120 -80.94 -15.22 56.86 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 124.356 1.062 . . . . 0.0 110.523 176.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.4 m -87.84 -22.21 24.59 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.808 2.043 . . . . 0.0 107.747 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.1 t -80.3 -33.52 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.537 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.41 -30.89 67.89 Favored 'General case' 0 C--N 1.394 2.503 0 C-N-CA 124.4 1.08 . . . . 0.0 112.375 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.1 m -75.72 -15.8 60.24 Favored 'General case' 0 C--N 1.406 3.058 0 C-N-CA 124.83 1.252 . . . . 0.0 111.694 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -88.31 -36.3 16.73 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.95 -40.53 91.4 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 125.328 1.451 . . . . 0.0 111.642 178.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.75 -38.71 67.0 Favored 'Isoleucine or valine' 0 C--N 1.391 2.392 0 CA-C-O 117.882 -1.056 . . . . 0.0 110.059 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -32.54 74.07 Favored 'General case' 0 C--N 1.387 2.222 0 CA-C-N 119.44 1.018 . . . . 0.0 112.944 174.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.7 -39.61 80.43 Favored 'General case' 0 C--N 1.383 2.028 0 C-N-CA 123.483 0.713 . . . . 0.0 110.898 176.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -67.9 -50.52 55.76 Favored 'General case' 0 C--N 1.391 2.37 0 C-N-CA 124.589 1.156 . . . . 0.0 109.831 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -39.17 92.02 Favored 'General case' 0 C--N 1.387 2.213 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.126 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -69.93 -21.81 63.25 Favored 'General case' 0 C--N 1.38 1.892 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 174.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 65.2 t60 -83.71 -20.78 32.85 Favored 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 36.8 t -75.77 -40.56 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.057 0 C-N-CA 126.091 1.756 . . . . 0.0 108.528 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -77.26 -28.77 53.64 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.991 0.916 . . . . 0.0 112.09 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 tttt -86.05 -12.28 50.6 Favored 'General case' 0 C--N 1.387 2.211 0 C-N-CA 123.472 0.709 . . . . 0.0 112.706 177.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -84.99 -22.42 29.11 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.048 2.139 . . . . 0.0 105.81 173.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -87.42 -50.54 6.49 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 126.36 1.864 . . . . 0.0 112.267 175.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.28 94.34 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.61 -5.95 37.25 Favored 'General case' 0 N--CA 1.518 2.952 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 178.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -104.42 -9.84 18.15 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.949 2.9 . . . . 0.0 109.776 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.276 11.9 mt-10 64.51 55.18 1.37 Allowed 'General case' 0 N--CA 1.522 3.148 0 C-N-CA 127.575 2.35 . . . . 0.0 113.225 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.4 126.12 52.09 Favored 'General case' 0 C--N 1.367 1.361 0 CA-C-N 112.575 -2.102 . . . . 0.0 110.474 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' B' ' 104' ' ' ASN . . . 98.3 -164.89 21.39 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 108.034 -2.026 . . . . 0.0 108.034 -174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.68 -172.76 2.18 Favored 'General case' 0 CA--C 1.557 1.242 0 CA-C-N 119.66 1.73 . . . . 0.0 109.082 176.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.42 67.94 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 53.2 Cg_exo -60.96 -17.35 50.91 Favored 'Trans proline' 1 C--N 1.458 6.298 0 CA-C-N 123.866 2.417 . . . . 0.0 116.971 -178.447 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -68.44 -27.73 66.44 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.519 0.728 . . . . 0.0 112.038 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.43 -34.95 47.55 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 127.059 2.144 . . . . 0.0 108.984 175.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 4.1 m-20 -60.76 -49.3 78.06 Favored 'General case' 0 N--CA 1.521 3.094 0 C-N-CA 125.809 1.644 . . . . 0.0 111.982 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -63.15 -45.08 93.57 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.905 2.082 . . . . 0.0 111.2 176.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -44.29 77.7 Favored 'General case' 0 C--N 1.393 2.472 0 C-N-CA 126.337 1.855 . . . . 0.0 115.855 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.11 -52.09 66.36 Favored 'General case' 0 C--N 1.393 2.465 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.0 mtm180 -60.07 -46.98 87.77 Favored 'General case' 0 C--N 1.407 3.107 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.92 -18.08 56.52 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.417 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.56 -41.96 87.83 Favored 'General case' 0 C--N 1.399 2.737 0 CA-C-N 118.376 0.534 . . . . 0.0 110.535 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -72.7 -22.91 60.83 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 125.204 1.402 . . . . 0.0 112.664 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.86 -44.91 17.67 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.509 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.38 -45.02 70.3 Favored 'General case' 0 C--N 1.389 2.284 0 C-N-CA 125.311 1.444 . . . . 0.0 113.614 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -71.63 -37.45 70.86 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 126.212 1.805 . . . . 0.0 111.318 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.52 -25.19 76.08 Favored Glycine 0 C--N 1.391 3.612 0 CA-C-N 119.452 1.024 . . . . 0.0 113.597 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.06 -27.73 60.09 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.185 1.394 . . . . 0.0 108.445 172.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.18 -36.98 93.92 Favored Glycine 1 C--N 1.404 4.344 0 C-N-CA 123.728 0.68 . . . . 0.0 114.761 172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -58.76 -47.63 84.03 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 126.151 1.781 . . . . 0.0 112.598 177.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -59.55 5.18 Favored 'General case' 0 C--N 1.395 2.566 0 C-N-CA 126.746 2.018 . . . . 0.0 114.905 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 1.1 mp -78.09 -13.51 59.84 Favored 'General case' 0 N--CA 1.521 3.112 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.6 2.43 84.76 Favored Glycine 0 C--N 1.363 2.077 0 N-CA-C 118.177 2.031 . . . . 0.0 118.177 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.19 131.28 35.39 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.42 125.49 26.28 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.461 1.105 . . . . 0.0 109.979 175.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 58' ' ' THR 0.279 0.5 OUTLIER -55.93 -46.82 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.665 0 C-N-CA 126.502 1.921 . . . . 0.0 115.291 -177.352 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.98 -46.07 86.23 Favored 'General case' 0 N--CA 1.527 3.404 0 CA-C-N 119.64 1.109 . . . . 0.0 113.698 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t -66.18 -31.63 72.59 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 123.281 0.633 . . . . 0.0 111.07 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.41 -27.97 60.86 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 124.772 1.295 . . . . 0.0 111.905 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 54' ' ' ILE . 67.9 p -66.21 -19.22 65.76 Favored 'General case' 0 C--N 1.419 3.623 0 CA-C-N 119.879 1.218 . . . . 0.0 112.433 176.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.6 mtt180 -99.6 -41.9 7.13 Favored 'General case' 0 C--N 1.397 2.67 0 CA-C-N 111.667 -2.515 . . . . 0.0 110.71 -173.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.64 -46.62 89.0 Favored 'General case' 0 N--CA 1.502 2.146 0 C-N-CA 126.407 1.883 . . . . 0.0 110.576 173.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.22 -34.15 64.45 Favored Glycine 0 C--N 1.388 3.438 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.055 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -48.93 -50.55 34.82 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.139 1.47 . . . . 0.0 113.009 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.42 -37.08 84.41 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 125.37 1.468 . . . . 0.0 111.674 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.352 0.1 OUTLIER -70.67 -15.44 18.94 Favored 'Isoleucine or valine' 0 CA--C 1.604 3.04 0 C-N-CA 126.64 1.976 . . . . 0.0 112.617 179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.619 ' O ' ' HB2' ' A' ' 69' ' ' LEU . 44.9 t -89.71 -44.28 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.738 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 177.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -65.15 -57.76 7.74 Favored 'General case' 0 CA--C 1.6 2.886 0 CA-C-N 112.635 -2.075 . . . . 0.0 112.524 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -77.17 -47.3 20.69 Favored 'General case' 0 N--CA 1.506 2.363 0 CA-C-N 111.633 -2.53 . . . . 0.0 117.23 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.264 0.5 OUTLIER -80.03 -15.09 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 122.028 2.194 . . . . 0.0 115.202 178.742 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 65' ' ' VAL . 9.7 mp -87.36 -19.73 27.74 Favored 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 118.318 -0.849 . . . . 0.0 110.925 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.94 -1.28 57.72 Favored 'General case' 0 CA--C 1.599 2.837 0 CA-C-O 122.572 1.177 . . . . 0.0 111.794 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 68' ' ' ILE . 3.3 mt-10 -82.69 -48.14 11.22 Favored 'General case' 0 N--CA 1.521 3.082 0 CA-C-N 111.995 -2.366 . . . . 0.0 113.033 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -149.42 139.65 22.23 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 127.44 2.296 . . . . 0.0 106.641 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-N 122.536 2.425 . . . . 0.0 111.758 178.062 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.2 156.78 33.02 Favored 'General case' 0 C--N 1.376 1.737 0 C-N-CA 124.901 1.281 . . . . 0.0 110.785 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 57.7 m -86.47 -2.58 58.58 Favored 'General case' 0 C--N 1.384 2.095 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLY . 12.8 m120 -80.96 -14.7 57.72 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 124.397 1.079 . . . . 0.0 110.511 176.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 8.6 m -88.72 -22.33 23.41 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 126.842 2.057 . . . . 0.0 107.681 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 58.9 t -80.08 -33.49 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.534 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 176.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -30.25 66.94 Favored 'General case' 0 C--N 1.394 2.514 0 C-N-CA 124.33 1.052 . . . . 0.0 112.343 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 72.7 m -77.74 -11.88 59.92 Favored 'General case' 0 C--N 1.408 3.122 0 C-N-CA 124.476 1.11 . . . . 0.0 111.801 174.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -91.3 -36.3 13.95 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -65.99 -40.55 91.29 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.577 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.93 -38.79 65.71 Favored 'Isoleucine or valine' 0 C--N 1.39 2.341 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.077 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -32.38 73.85 Favored 'General case' 0 C--N 1.388 2.274 0 CA-C-N 119.584 1.084 . . . . 0.0 113.003 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 99.5 m -68.85 -39.63 79.81 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 123.456 0.702 . . . . 0.0 110.942 176.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.9 -50.51 55.8 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 124.629 1.171 . . . . 0.0 109.791 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.18 -39.12 91.65 Favored 'General case' 0 C--N 1.389 2.284 0 O-C-N 124.216 0.948 . . . . 0.0 112.125 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -21.48 63.1 Favored 'General case' 0 C--N 1.381 1.956 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.543 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 65.1 t60 -83.86 -21.14 32.08 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 37.2 t -75.29 -40.67 43.26 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.013 0 C-N-CA 126.075 1.75 . . . . 0.0 108.425 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -77.21 -28.46 53.86 Favored 'General case' 0 C--N 1.381 1.947 0 C-N-CA 123.885 0.874 . . . . 0.0 112.032 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 12.5 tttt -88.79 -5.66 57.91 Favored 'General case' 0 C--N 1.392 2.423 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.0 OUTLIER -90.35 -21.21 22.11 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 127.75 2.42 . . . . 0.0 105.501 173.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.32 -50.1 6.33 Favored 'General case' 0 CA--C 1.578 2.026 0 C-N-CA 126.261 1.824 . . . . 0.0 111.871 175.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.24 -42.32 93.48 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.66 -3.77 27.0 Favored 'General case' 0 N--CA 1.519 3.013 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 178.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -106.02 -9.74 16.89 Favored 'General case' 0 CA--C 1.568 1.647 0 C-N-CA 128.985 2.914 . . . . 0.0 109.749 176.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 12.1 mt-10 64.54 55.08 1.37 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 127.534 2.334 . . . . 0.0 113.265 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.33 126.1 52.03 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 112.609 -2.087 . . . . 0.0 110.51 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.483 ' H ' ' HB3' ' A' ' 4' ' ' ASN . . . 98.27 -164.63 21.36 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 112.694 -2.048 . . . . 0.0 108.042 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.84 -172.81 2.18 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 119.672 1.736 . . . . 0.0 109.095 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.96 -38.37 67.4 Favored Pre-proline 0 CA--C 1.591 2.538 0 N-CA-C 116.355 1.984 . . . . 0.0 116.355 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.63 -15.55 42.52 Favored 'Trans proline' 1 C--N 1.458 6.338 0 CA-C-N 123.863 2.415 . . . . 0.0 117.063 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -69.69 -27.63 65.17 Favored 'General case' 0 C--N 1.394 2.511 0 C-N-CA 123.424 0.69 . . . . 0.0 111.984 178.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -34.88 47.04 Favored 'General case' 0 C--N 1.383 2.029 0 C-N-CA 127.037 2.135 . . . . 0.0 109.023 175.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -60.72 -49.33 77.93 Favored 'General case' 0 N--CA 1.521 3.088 0 C-N-CA 125.86 1.664 . . . . 0.0 112.063 172.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -63.2 -45.08 93.39 Favored 'General case' 0 C--N 1.403 2.917 0 C-N-CA 126.968 2.107 . . . . 0.0 111.183 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.78 -44.28 77.59 Favored 'General case' 0 C--N 1.393 2.469 0 C-N-CA 126.295 1.838 . . . . 0.0 115.951 176.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -61.03 -52.13 66.3 Favored 'General case' 0 C--N 1.394 2.511 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -60.23 -46.84 88.38 Favored 'General case' 0 C--N 1.408 3.126 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 -18.13 56.41 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 114.327 -1.306 . . . . 0.0 113.424 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -66.52 -42.02 87.92 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 118.333 0.515 . . . . 0.0 110.579 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -72.54 -23.08 60.94 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 125.273 1.429 . . . . 0.0 112.752 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.8 -45.0 17.64 Favored 'General case' 0 C--N 1.388 2.271 0 CA-C-N 112.282 -2.235 . . . . 0.0 110.534 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.3 -45.02 70.57 Favored 'General case' 0 C--N 1.387 2.239 0 C-N-CA 125.351 1.461 . . . . 0.0 113.628 178.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -71.63 -37.45 70.88 Favored 'General case' 0 C--N 1.387 2.201 0 C-N-CA 126.15 1.78 . . . . 0.0 111.36 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.68 -25.03 76.4 Favored Glycine 0 C--N 1.392 3.688 0 CA-C-N 119.44 1.018 . . . . 0.0 113.611 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -75.02 -27.64 60.16 Favored 'General case' 0 C--N 1.382 2.007 0 C-N-CA 125.24 1.416 . . . . 0.0 108.325 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.57 -36.87 93.68 Favored Glycine 1 C--N 1.404 4.331 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 172.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 62.3 m -58.6 -47.55 83.94 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 126.234 1.814 . . . . 0.0 112.478 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -68.5 0.19 Allowed 'General case' 0 C--N 1.393 2.484 0 C-N-CA 127.546 2.338 . . . . 0.0 113.943 175.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 1.1 mp -71.71 -15.82 62.21 Favored 'General case' 0 N--CA 1.519 3.004 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 91.13 -7.25 81.07 Favored Glycine 0 C--N 1.366 2.248 0 N-CA-C 118.295 2.078 . . . . 0.0 118.295 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.23 131.36 37.09 Favored 'General case' 0 CA--C 1.558 1.271 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -177.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.59 125.86 27.85 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 124.093 0.957 . . . . 0.0 109.936 174.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.469 ' O ' HG23 ' B' ' 158' ' ' THR 0.282 0.5 OUTLIER -55.65 -47.4 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.671 0 C-N-CA 126.613 1.965 . . . . 0.0 115.343 -177.331 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -63.65 -46.08 87.28 Favored 'General case' 0 N--CA 1.528 3.471 0 CA-C-N 119.618 1.099 . . . . 0.0 113.76 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.8 t -66.03 -31.33 72.16 Favored 'General case' 0 N--CA 1.511 2.612 0 C-N-CA 123.294 0.637 . . . . 0.0 111.011 176.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -74.87 -27.55 60.29 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 124.826 1.329 . . . . 0.0 111.708 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.469 HG23 ' O ' ' B' ' 154' ' ' ILE . 63.0 p -68.15 -11.86 59.92 Favored 'General case' 0 C--N 1.42 3.668 0 CA-C-N 119.952 1.251 . . . . 0.0 113.075 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -109.41 -40.08 5.0 Favored 'General case' 0 C--N 1.392 2.426 0 CA-C-N 112.35 -2.205 . . . . 0.0 109.946 -172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.69 87.75 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 125.993 1.717 . . . . 0.0 110.161 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.18 -34.92 64.22 Favored Glycine 0 C--N 1.389 3.508 0 CA-C-O 117.249 -1.862 . . . . 0.0 114.096 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -48.42 -50.2 31.97 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 119.145 1.473 . . . . 0.0 112.882 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -66.6 -36.81 83.5 Favored 'General case' 0 C--N 1.393 2.494 0 C-N-CA 125.274 1.429 . . . . 0.0 111.44 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -74.6 -3.71 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.606 3.131 0 C-N-CA 126.003 1.721 . . . . 0.0 113.472 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . 0.63 ' O ' ' HB2' ' B' ' 169' ' ' LEU . 41.6 t -100.49 -44.07 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.591 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -65.58 -56.47 12.1 Favored 'General case' 0 CA--C 1.598 2.821 0 CA-C-N 112.659 -2.064 . . . . 0.0 112.323 178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -78.76 -46.9 17.84 Favored 'General case' 0 N--CA 1.503 2.21 0 CA-C-N 111.474 -2.603 . . . . 0.0 117.168 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -82.88 -7.23 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.75 0 CA-C-N 122.512 2.414 . . . . 0.0 115.42 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.63 ' HB2' ' O ' ' B' ' 165' ' ' VAL . 9.5 mp -93.35 -19.12 21.64 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.48 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.6 6.51 40.85 Favored 'General case' 0 CA--C 1.601 2.911 0 CA-C-O 123.222 1.487 . . . . 0.0 112.03 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -84.02 -68.45 0.71 Allowed 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 111.014 -2.812 . . . . 0.0 110.336 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -132.22 137.65 47.64 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 127.826 2.451 . . . . 0.0 107.48 176.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.495 1.78 0 CA-C-N 122.276 2.307 . . . . 0.0 111.782 178.587 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 119.917 -0.087 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.32 -3.98 17.87 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 124.697 1.199 . . . . 0.0 112.501 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.5 m -158.85 116.02 2.78 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -75.71 -8.59 57.22 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.6 24.22 Favored 'General case' 0 CA--C 1.57 1.739 0 C-N-CA 123.913 0.885 . . . . 0.0 110.47 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.94 -39.34 12.07 Favored 'Isoleucine or valine' 0 C--N 1.375 1.689 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.222 -177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -71.56 -28.42 63.84 Favored 'General case' 0 C--N 1.387 2.224 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 174.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.8 m -75.34 -17.56 60.21 Favored 'General case' 0 C--N 1.399 2.741 0 C-N-CA 124.341 1.057 . . . . 0.0 111.096 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -87.77 -44.1 11.38 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -64.15 -41.31 97.22 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 125.42 1.488 . . . . 0.0 112.985 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -71.03 -38.05 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 C-N-CA 124.614 1.165 . . . . 0.0 110.699 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.95 -28.95 68.7 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 119.053 0.842 . . . . 0.0 111.898 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.69 -40.35 84.36 Favored 'General case' 0 C--N 1.397 2.659 0 C-N-CA 124.287 1.035 . . . . 0.0 112.037 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -66.68 -47.54 72.14 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 124.435 1.094 . . . . 0.0 108.812 174.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.06 Favored 'General case' 0 C--N 1.383 2.055 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -64.98 -34.6 78.81 Favored 'General case' 0 CA--C 1.58 2.13 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.561 170.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 64.1 t60 -76.51 -24.42 53.71 Favored 'General case' 0 N--CA 1.512 2.632 0 CA-C-N 119.864 1.211 . . . . 0.0 108.959 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 91.3 t -73.02 -40.53 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.933 0 O-C-N 125.423 1.702 . . . . 0.0 107.322 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.51 -29.03 59.36 Favored 'General case' 0 CA--C 1.584 2.28 0 C-N-CA 123.741 0.816 . . . . 0.0 112.175 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.5 -11.25 52.24 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.41 HH12 HG23 ' B' ' 168' ' ' ILE . 0.0 OUTLIER -88.74 -23.41 22.93 Favored 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 128.642 2.777 . . . . 0.0 107.467 174.681 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -85.21 -49.76 7.94 Favored 'General case' 0 CA--C 1.585 2.301 0 C-N-CA 126.76 2.024 . . . . 0.0 110.321 173.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -6.69 46.96 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 1.9 mt-30 -103.45 11.84 35.94 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 128.672 2.789 . . . . 0.0 112.757 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 25' ' ' GLN . 10.4 mt-10 82.58 15.89 0.39 Allowed 'General case' 1 N--CA 1.555 4.815 0 C-N-CA 124.633 1.173 . . . . 0.0 114.13 176.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.49 1.28 32.16 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.573 0.702 . . . . 0.0 111.079 -176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.13 3.61 Favored Glycine 0 C--N 1.363 2.043 0 CA-C-N 114.509 -1.223 . . . . 0.0 113.82 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.61 -177.03 3.27 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.09 -2.055 . . . . 0.0 108.167 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.91 -47.09 98.05 Favored Pre-proline 0 C--N 1.392 2.418 0 CA-C-O 115.227 -2.321 . . . . 0.0 115.49 -177.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.88 -38.55 92.02 Favored 'Trans proline' 1 C--N 1.453 6.027 0 CA-C-N 124.427 2.617 . . . . 0.0 115.212 177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.72 -45.47 71.44 Favored 'General case' 0 C--N 1.396 2.587 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -31.29 53.22 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 125.896 1.678 . . . . 0.0 112.19 -177.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.4 69.55 Favored 'General case' 0 N--CA 1.509 2.509 0 C-N-CA 125.122 1.369 . . . . 0.0 110.942 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -66.46 -40.78 89.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.932 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -48.1 82.84 Favored 'General case' 0 C--N 1.4 2.77 0 N-CA-C 117.138 2.273 . . . . 0.0 117.138 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.82 -42.37 95.03 Favored 'General case' 0 C--N 1.398 2.714 0 C-N-CA 125.802 1.641 . . . . 0.0 115.159 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.66 -49.65 72.36 Favored 'General case' 0 C--N 1.396 2.597 0 CA-C-N 112.155 -2.293 . . . . 0.0 111.037 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.06 -15.74 52.51 Favored 'General case' 0 C--N 1.374 1.656 0 CA-C-N 112.612 -2.086 . . . . 0.0 112.634 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -68.16 -42.52 79.93 Favored 'General case' 0 C--N 1.401 2.811 0 CA-C-N 119.089 0.859 . . . . 0.0 111.066 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -72.24 -20.8 61.48 Favored 'General case' 0 C--N 1.396 2.589 0 C-N-CA 125.158 1.383 . . . . 0.0 111.641 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t -81.42 -42.92 19.67 Favored 'General case' 0 C--N 1.391 2.409 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.097 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -50.63 50.3 Favored 'General case' 0 C--N 1.405 2.995 0 C-N-CA 125.767 1.627 . . . . 0.0 112.467 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.16 -36.46 74.72 Favored 'General case' 0 C--N 1.393 2.475 0 C-N-CA 126.464 1.906 . . . . 0.0 111.549 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.16 83.22 Favored Glycine 0 C--N 1.394 3.785 0 CA-C-N 119.896 1.225 . . . . 0.0 113.635 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -28.65 63.05 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 113.023 -1.588 . . . . 0.0 109.711 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.26 -37.48 94.94 Favored Glycine 1 C--N 1.405 4.382 0 CA-C-N 119.353 0.979 . . . . 0.0 115.264 173.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.7 m -59.3 -48.38 81.84 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 126.195 1.798 . . . . 0.0 112.681 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.07 -60.73 3.29 Favored 'General case' 0 C--N 1.399 2.742 0 C-N-CA 126.846 2.059 . . . . 0.0 115.086 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.262 10.0 mt -78.13 -14.43 59.48 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 178.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.81 47.78 9.36 Favored Glycine 0 C--N 1.362 2.027 0 N-CA-C 118.423 2.129 . . . . 0.0 118.423 172.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.84 137.97 53.79 Favored 'General case' 0 C--O 1.257 1.482 0 CA-C-N 120.402 2.101 . . . . 0.0 110.202 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.4 121.93 16.84 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-O 121.574 0.702 . . . . 0.0 110.626 174.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.258 0.8 OUTLIER -57.82 -43.98 85.29 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.728 0 C-N-CA 127.104 2.162 . . . . 0.0 114.437 -178.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -63.84 -43.57 95.77 Favored 'General case' 0 N--CA 1.525 3.278 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 t -72.3 -26.6 62.02 Favored 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 123.607 0.763 . . . . 0.0 109.942 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.55 -27.9 61.58 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 124.441 1.088 . . . . 0.0 111.379 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.0 p -67.56 -18.48 65.03 Favored 'General case' 0 C--N 1.417 3.539 0 CA-C-N 119.616 1.098 . . . . 0.0 112.054 175.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -98.99 -42.51 7.08 Favored 'General case' 0 C--N 1.402 2.871 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.695 -175.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.01 75.18 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 126.216 1.806 . . . . 0.0 109.936 174.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.89 -29.19 67.49 Favored Glycine 0 C--N 1.388 3.455 0 CA-C-O 116.857 -2.08 . . . . 0.0 114.024 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.75 -46.0 40.48 Favored 'General case' 0 N--CA 1.517 2.881 0 CA-C-N 119.352 1.576 . . . . 0.0 112.083 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 83.2 mt-30 -68.45 -34.88 76.76 Favored 'General case' 0 C--N 1.391 2.413 0 C-N-CA 125.048 1.339 . . . . 0.0 111.589 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.581 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.266 10.9 mt -76.95 -18.0 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.597 2.788 0 C-N-CA 124.98 1.312 . . . . 0.0 112.028 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -92.33 -57.69 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.904 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -56.33 -71.03 0.1 Allowed 'General case' 0 C--N 1.381 1.945 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.213 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 98.2 mtt180 -53.01 -37.04 61.16 Favored 'General case' 0 C--N 1.406 3.045 0 CA-C-O 114.828 -2.51 . . . . 0.0 116.898 173.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.367 0.1 OUTLIER -64.36 -16.14 18.69 Favored 'Isoleucine or valine' 0 C--N 1.406 3.027 0 CA-C-N 122.831 2.56 . . . . 0.0 114.228 178.434 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -31.26 16.48 Favored 'General case' 0 C--N 1.396 2.598 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -82.65 -15.49 51.87 Favored 'General case' 0 N--CA 1.527 3.39 0 CA-C-O 123.262 1.506 . . . . 0.0 112.407 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.7 mt-10 -87.1 20.33 2.75 Favored 'General case' 0 N--CA 1.516 2.834 0 C-N-CA 129.26 3.024 . . . . 0.0 113.887 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -102.73 -17.14 15.75 Favored 'General case' 0 C--N 1.376 1.756 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.381 1.94 0 CA-C-N 119.106 0.866 . . . . 0.0 112.168 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.748 ' N ' ' HG ' ' B' ' 107' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 119.962 -0.066 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.62 -3.84 17.62 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 124.673 1.189 . . . . 0.0 112.405 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 34.0 m -158.98 116.68 2.82 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -78.03 -3.8 43.94 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.0 -27.14 21.07 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 124.096 0.958 . . . . 0.0 110.381 177.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 1.4 t -93.38 -38.46 9.79 Favored 'Isoleucine or valine' 0 C--N 1.374 1.646 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.832 -176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . 0.748 ' HG ' ' N ' ' B' ' 101' ' ' MET . 10.4 m -72.14 -28.12 63.05 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-N 118.935 0.789 . . . . 0.0 112.829 174.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 43.9 m -76.52 -15.52 59.86 Favored 'General case' 0 C--N 1.402 2.88 0 C-N-CA 123.99 0.916 . . . . 0.0 111.227 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -89.04 -44.35 10.44 Favored 'General case' 0 CA--C 1.576 1.967 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -64.03 -41.25 97.48 Favored 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 125.434 1.493 . . . . 0.0 112.975 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 39.6 t -71.14 -38.16 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 124.557 1.143 . . . . 0.0 110.7 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -28.95 68.84 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.144 0.883 . . . . 0.0 111.936 173.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.77 -40.45 84.0 Favored 'General case' 0 C--N 1.396 2.625 0 C-N-CA 124.301 1.04 . . . . 0.0 111.989 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.7 -47.52 72.14 Favored 'General case' 0 C--N 1.392 2.442 0 C-N-CA 124.394 1.078 . . . . 0.0 108.857 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.57 -36.82 85.05 Favored 'General case' 0 C--N 1.383 2.036 0 O-C-N 124.387 1.054 . . . . 0.0 113.612 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -64.89 -34.78 79.19 Favored 'General case' 0 CA--C 1.58 2.129 0 CA-C-O 117.908 -1.044 . . . . 0.0 112.61 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 64.3 t60 -76.28 -24.82 54.44 Favored 'General case' 0 C--N 1.396 2.607 0 CA-C-N 119.937 1.244 . . . . 0.0 108.984 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -72.64 -40.5 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 O-C-N 125.522 1.764 . . . . 0.0 107.226 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -75.74 -28.33 58.47 Favored 'General case' 0 CA--C 1.584 2.284 0 C-N-CA 123.551 0.74 . . . . 0.0 112.143 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.87 -3.98 57.81 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 177.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.439 HH12 HG23 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -94.45 -23.37 17.76 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 129.344 3.058 . . . . 0.0 107.113 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -85.65 -49.59 7.88 Favored 'General case' 0 CA--C 1.584 2.263 0 C-N-CA 126.674 1.99 . . . . 0.0 110.078 173.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.79 98.73 Favored 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.38 -5.39 39.5 Favored 'General case' 0 N--CA 1.52 3.051 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' B' ' 126' ' ' GLU . 2.1 mt-30 -103.73 8.55 37.3 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 128.72 2.808 . . . . 0.0 113.104 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' B' ' 125' ' ' GLN . 10.3 mt-10 87.79 11.21 0.12 Allowed 'General case' 1 N--CA 1.556 4.848 0 C-N-CA 124.642 1.177 . . . . 0.0 113.839 176.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 mt -100.27 1.42 41.72 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.521 0.677 . . . . 0.0 111.516 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -97.13 108.09 3.6 Favored Glycine 0 C--N 1.362 1.983 0 CA-C-N 114.547 -1.206 . . . . 0.0 113.83 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -176.81 3.21 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.196 -2.002 . . . . 0.0 108.259 176.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.99 -47.23 97.71 Favored Pre-proline 0 C--N 1.391 2.374 0 CA-C-O 115.263 -2.303 . . . . 0.0 115.4 -177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.97 -38.42 92.19 Favored 'Trans proline' 1 C--N 1.452 6.022 0 CA-C-N 124.465 2.631 . . . . 0.0 115.207 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.7 -45.62 71.14 Favored 'General case' 0 C--N 1.395 2.57 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.42 -31.38 53.96 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 125.974 1.71 . . . . 0.0 112.229 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.65 -51.38 69.62 Favored 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 125.1 1.36 . . . . 0.0 110.893 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -66.4 -40.82 89.86 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.725 1.61 . . . . 0.0 111.871 177.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -48.19 82.54 Favored 'General case' 0 C--N 1.4 2.772 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -64.72 -42.35 95.29 Favored 'General case' 0 C--N 1.398 2.679 0 C-N-CA 125.801 1.64 . . . . 0.0 115.168 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -63.67 -49.6 72.53 Favored 'General case' 0 C--N 1.397 2.639 0 CA-C-N 112.169 -2.287 . . . . 0.0 111.031 -176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.93 -13.7 55.55 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 112.669 -2.059 . . . . 0.0 112.75 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -69.51 -42.27 74.93 Favored 'General case' 0 C--N 1.402 2.87 0 CA-C-N 119.044 0.838 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -72.39 -20.7 61.39 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 125.174 1.39 . . . . 0.0 111.546 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.31 -43.18 19.49 Favored 'General case' 0 C--N 1.391 2.385 0 CA-C-N 112.314 -2.221 . . . . 0.0 109.112 179.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -50.57 51.27 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 125.715 1.606 . . . . 0.0 112.429 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -70.18 -36.66 74.81 Favored 'General case' 0 C--N 1.391 2.408 0 C-N-CA 126.524 1.93 . . . . 0.0 111.518 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.7 -32.13 83.12 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 119.938 1.244 . . . . 0.0 113.722 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -72.35 -28.72 63.22 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 112.949 -1.626 . . . . 0.0 109.665 175.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.4 -37.5 94.92 Favored Glycine 1 C--N 1.406 4.425 0 CA-C-N 119.354 0.979 . . . . 0.0 115.336 173.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.3 m -59.11 -48.18 82.54 Favored 'General case' 0 N--CA 1.51 2.536 0 C-N-CA 126.093 1.757 . . . . 0.0 112.507 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.69 -70.54 0.1 Allowed 'General case' 0 C--N 1.398 2.701 0 C-N-CA 127.478 2.311 . . . . 0.0 114.108 176.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 9.8 mt -71.15 -16.38 62.54 Favored 'General case' 0 N--CA 1.514 2.738 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.65 52.08 6.14 Favored Glycine 0 C--N 1.364 2.087 0 N-CA-C 118.346 2.098 . . . . 0.0 118.346 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.46 137.82 52.0 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-N 120.118 1.959 . . . . 0.0 110.103 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.27 121.89 16.68 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.583 0.706 . . . . 0.0 110.665 174.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.8 OUTLIER -57.61 -44.07 84.57 Favored 'Isoleucine or valine' 0 CA--C 1.596 2.736 0 C-N-CA 127.161 2.184 . . . . 0.0 114.462 -178.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -63.77 -44.03 94.61 Favored 'General case' 0 N--CA 1.524 3.235 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.4 t -71.64 -26.41 62.54 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 123.511 0.724 . . . . 0.0 109.907 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.97 -27.41 60.98 Favored 'General case' 0 C--N 1.379 1.889 0 O-C-N 124.545 1.153 . . . . 0.0 111.364 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 72.3 p -69.1 -12.05 61.34 Favored 'General case' 0 C--N 1.419 3.597 0 CA-C-N 119.676 1.125 . . . . 0.0 112.566 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 -108.32 -40.49 5.14 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 112.146 -2.297 . . . . 0.0 109.973 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.51 -50.18 73.74 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 125.893 1.677 . . . . 0.0 109.427 173.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -71.75 -29.72 67.08 Favored Glycine 0 C--N 1.39 3.56 0 CA-C-O 117.04 -1.978 . . . . 0.0 114.145 173.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -48.5 -45.64 37.31 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 119.254 1.527 . . . . 0.0 112.106 170.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 83.3 mt-30 -68.33 -34.8 76.75 Favored 'General case' 0 C--N 1.39 2.36 0 C-N-CA 124.935 1.294 . . . . 0.0 111.626 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.468 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 8.7 mt -80.16 -7.19 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.989 0 C-N-CA 124.79 1.236 . . . . 0.0 112.848 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 72.3 t -103.18 -56.55 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.878 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.35 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.377 1.776 0 O-C-N 126.341 2.276 . . . . 0.0 108.457 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.6 mtt180 -47.85 -36.76 12.53 Favored 'General case' 0 C--N 1.399 2.758 0 CA-C-O 114.496 -2.668 . . . . 0.0 116.859 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.318 0.1 OUTLIER -67.87 -6.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.416 3.481 0 CA-C-N 123.626 2.921 . . . . 0.0 114.773 178.437 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.46 -30.12 12.36 Favored 'General case' 0 C--N 1.392 2.443 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -83.54 -15.17 50.31 Favored 'General case' 0 N--CA 1.525 3.281 0 CA-C-O 123.295 1.521 . . . . 0.0 111.95 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.7 mt-10 -87.38 21.06 2.58 Favored 'General case' 0 N--CA 1.515 2.793 0 C-N-CA 129.088 2.955 . . . . 0.0 113.956 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -103.6 -16.9 15.37 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.382 2.016 0 CA-C-N 119.204 0.911 . . . . 0.0 112.249 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 mtt . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 121.476 0.655 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.44 162.08 16.55 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 124.301 1.04 . . . . 0.0 112.17 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.4 m -87.59 5.69 38.17 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.45 -11.98 56.89 Favored 'General case' 0 N--CA 1.511 2.604 0 C-N-CA 124.75 1.22 . . . . 0.0 110.694 173.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.9 m -92.34 -20.95 20.56 Favored 'General case' 0 CA--C 1.583 2.231 0 C-N-CA 126.777 2.031 . . . . 0.0 107.886 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 89.6 t -87.08 -37.44 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 CA-C-N 113.991 -1.459 . . . . 0.0 107.548 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -70.17 -29.17 65.98 Favored 'General case' 0 C--N 1.382 2.005 0 C-N-CA 124.559 1.143 . . . . 0.0 111.327 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 59.2 m -75.89 -16.78 59.99 Favored 'General case' 0 C--N 1.388 2.273 0 C-N-CA 124.492 1.117 . . . . 0.0 111.416 173.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -89.28 -40.29 12.91 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -64.62 -38.19 90.14 Favored 'General case' 0 N--CA 1.513 2.677 0 C-N-CA 125.392 1.477 . . . . 0.0 112.581 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.4 t -70.19 -39.69 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.16 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.26 -33.54 75.97 Favored 'General case' 0 C--N 1.384 2.094 0 CA-C-N 119.484 1.038 . . . . 0.0 112.774 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.462 ' O ' HG22 ' A' ' 58' ' ' THR . 91.3 m -67.86 -42.51 81.2 Favored 'General case' 0 C--N 1.397 2.66 0 C-N-CA 123.826 0.85 . . . . 0.0 111.579 177.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -63.08 -44.85 94.59 Favored 'General case' 0 C--N 1.388 2.272 0 C-N-CA 125.058 1.343 . . . . 0.0 107.885 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.644 HD21 HD21 ' B' ' 115' ' ' LEU . 0.3 OUTLIER -64.83 -35.22 80.4 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 124.713 1.258 . . . . 0.0 114.218 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 43.4 t90 -63.98 -27.76 69.35 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-O 118.064 -0.969 . . . . 0.0 112.891 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 26.0 t60 -85.5 -23.35 27.79 Favored 'General case' 0 CA--C 1.579 2.068 0 CA-C-N 119.732 1.151 . . . . 0.0 109.548 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.8 -40.65 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 125.039 1.462 . . . . 0.0 108.459 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.01 -28.59 39.37 Favored 'General case' 0 C--N 1.379 1.863 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -83.43 -9.05 59.25 Favored 'General case' 0 C--N 1.394 2.523 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 176.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 2.9 tpt180 -88.87 -28.03 20.63 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 128.431 2.693 . . . . 0.0 107.077 173.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -82.56 -45.49 14.56 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.34 1.856 . . . . 0.0 111.064 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.15 -40.79 86.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.336 1.055 . . . . 0.0 113.14 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -72.25 -7.39 49.07 Favored 'General case' 0 N--CA 1.518 2.925 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 178.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -104.06 -6.97 20.63 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 128.205 2.602 . . . . 0.0 110.829 177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.363 9.0 mt-10 67.44 47.07 1.3 Allowed 'General case' 0 N--CA 1.521 3.105 0 C-N-CA 128.27 2.628 . . . . 0.0 114.703 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.82 -1.76 13.83 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.892 -2.413 . . . . 0.0 107.406 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.63 110.9 4.13 Favored Glycine 0 C--N 1.365 2.15 0 CA-C-N 111.583 -2.553 . . . . 0.0 111.3 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.61 178.76 4.9 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 112.962 -1.619 . . . . 0.0 112.609 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.98 -48.05 89.41 Favored Pre-proline 0 CA--C 1.591 2.541 0 CA-C-O 116.561 -1.685 . . . . 0.0 112.644 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -68.25 -14.07 39.47 Favored 'Trans proline' 1 C--N 1.442 5.477 0 C-N-CA 124.157 3.238 . . . . 0.0 116.031 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -97.65 -32.63 11.67 Favored 'General case' 0 C--N 1.405 3.018 0 C-N-CA 119.096 -1.041 . . . . 0.0 108.429 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.6 -31.32 36.74 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 128.011 2.524 . . . . 0.0 110.602 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.07 -51.55 69.57 Favored 'General case' 0 N--CA 1.511 2.588 0 C-N-CA 125.44 1.496 . . . . 0.0 110.487 172.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -63.18 -45.26 92.62 Favored 'General case' 0 C--N 1.402 2.881 0 O-C-N 125.631 1.832 . . . . 0.0 110.833 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -58.21 -52.05 67.17 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 116.234 1.938 . . . . 0.0 116.234 176.398 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -56.34 -52.62 63.88 Favored 'General case' 0 C--N 1.416 3.493 0 CA-C-N 120.665 1.575 . . . . 0.0 115.247 -173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mtm180 -56.65 -41.81 77.83 Favored 'General case' 0 C--N 1.406 3.029 0 O-C-N 124.474 1.108 . . . . 0.0 112.805 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.03 -16.35 50.49 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.024 -1.444 . . . . 0.0 113.348 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 55.8 mt-30 -69.37 -41.57 76.35 Favored 'General case' 0 C--N 1.414 3.41 0 CA-C-N 120.276 1.398 . . . . 0.0 109.545 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -73.46 -22.27 60.23 Favored 'General case' 0 C--N 1.39 2.35 0 C-N-CA 125.206 1.402 . . . . 0.0 112.646 179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.3 t -80.05 -43.12 22.41 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 112.508 -2.133 . . . . 0.0 110.069 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -46.24 74.28 Favored 'General case' 0 C--N 1.386 2.194 0 C-N-CA 125.241 1.416 . . . . 0.0 112.215 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -70.9 -37.91 72.99 Favored 'General case' 0 C--N 1.389 2.308 0 C-N-CA 126.936 2.095 . . . . 0.0 111.875 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.38 -31.4 80.73 Favored Glycine 0 C--N 1.395 3.85 0 CA-C-N 120.207 1.367 . . . . 0.0 113.285 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.21 -28.75 63.39 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-N 112.704 -1.748 . . . . 0.0 109.505 174.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.08 -38.6 96.83 Favored Glycine 1 C--N 1.405 4.413 0 CA-C-N 119.28 0.945 . . . . 0.0 115.089 173.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.9 m -59.92 -48.79 80.25 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.066 1.746 . . . . 0.0 113.148 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.79 -60.02 4.34 Favored 'General case' 0 N--CA 1.514 2.754 0 C-N-CA 126.961 2.104 . . . . 0.0 114.594 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.264 9.6 mt -78.34 -12.53 60.01 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.64 45.97 20.57 Favored Glycine 0 C--N 1.366 2.219 0 N-CA-C 118.219 2.048 . . . . 0.0 118.219 172.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.31 136.36 54.64 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 120.03 1.915 . . . . 0.0 109.923 -177.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.57 120.55 14.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.565 0.746 . . . . 0.0 110.05 174.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.496 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -57.46 -42.1 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 C-N-CA 126.712 2.005 . . . . 0.0 114.166 -178.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.55 -42.14 95.89 Favored 'General case' 0 N--CA 1.514 2.756 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 177.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 -28.3 55.6 Favored 'General case' 0 C--N 1.382 2.009 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.22 -27.6 62.63 Favored 'General case' 0 C--N 1.379 1.856 0 O-C-N 124.714 1.259 . . . . 0.0 111.968 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.9 p -60.79 -51.54 68.9 Favored 'General case' 0 C--N 1.404 2.975 0 CA-C-O 122.281 1.039 . . . . 0.0 109.923 174.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -62.74 -42.35 99.63 Favored 'General case' 0 N--CA 1.519 3.02 0 CA-C-N 111.447 -2.615 . . . . 0.0 113.673 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.81 78.5 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 125.949 1.7 . . . . 0.0 111.194 174.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.31 -27.43 68.03 Favored Glycine 0 C--N 1.392 3.661 0 CA-C-O 117.51 -1.717 . . . . 0.0 115.289 175.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -48.54 -48.79 38.23 Favored 'General case' 0 N--CA 1.507 2.396 0 CA-C-N 118.199 0.999 . . . . 0.0 111.881 170.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -68.13 -35.69 78.52 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 125.489 1.515 . . . . 0.0 112.445 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.6 HG12 ' HA2' ' A' ' 61' ' ' GLY 0.455 0.9 OUTLIER -68.34 -55.7 15.3 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-O 115.795 -2.05 . . . . 0.0 111.969 179.417 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 61' ' ' GLY . 11.2 t -51.48 -50.13 30.24 Favored 'Isoleucine or valine' 1 N--CA 1.546 4.364 0 CA-C-N 121.087 1.767 . . . . 0.0 111.405 175.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -56.4 -72.71 0.07 Allowed 'General case' 0 C--N 1.377 1.802 0 O-C-N 125.897 1.998 . . . . 0.0 110.562 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -55.83 -39.85 71.97 Favored 'General case' 0 C--N 1.399 2.755 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.343 1.7 pp -65.41 -17.14 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.963 0 CA-C-N 123.695 2.952 . . . . 0.0 114.709 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.67 -27.77 17.88 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -82.14 -15.88 51.81 Favored 'General case' 0 N--CA 1.523 3.193 0 CA-C-O 123.406 1.574 . . . . 0.0 111.701 176.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.37 13.59 11.39 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 129.393 3.077 . . . . 0.0 113.551 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -98.89 -15.7 19.09 Favored 'General case' 0 C--N 1.373 1.592 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.13 0 C-N-CA 123.98 0.912 . . . . 0.0 111.945 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.1 mtt . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 121.541 0.686 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.87 162.1 16.2 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 124.287 1.035 . . . . 0.0 111.979 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 73.4 m -88.04 6.32 36.69 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -84.53 -8.73 58.83 Favored 'General case' 0 N--CA 1.51 2.56 0 C-N-CA 125.023 1.329 . . . . 0.0 110.813 173.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.9 m -97.63 -18.62 18.8 Favored 'General case' 0 CA--C 1.577 1.984 0 C-N-CA 126.887 2.075 . . . . 0.0 107.49 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . 0.407 HG12 HE21 ' B' ' 110' ' ' GLN . 87.9 t -88.7 -37.33 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.1 m -70.51 -28.57 65.06 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 124.476 1.11 . . . . 0.0 111.433 173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 60.0 m -76.96 -14.14 59.89 Favored 'General case' 0 C--N 1.391 2.39 0 C-N-CA 124.029 0.932 . . . . 0.0 111.68 173.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -91.73 -40.18 11.39 Favored 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . 0.407 HE21 HG12 ' B' ' 106' ' ' VAL . 41.2 mt-30 -64.51 -38.54 91.37 Favored 'General case' 0 N--CA 1.511 2.611 0 C-N-CA 125.21 1.404 . . . . 0.0 112.566 178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 73.3 t -69.94 -39.78 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 CA-C-O 117.571 -1.204 . . . . 0.0 109.205 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.27 -33.28 75.4 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-N 119.658 1.117 . . . . 0.0 112.893 176.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . 0.452 ' O ' HG22 ' B' ' 158' ' ' THR . 89.6 m -68.25 -42.81 79.11 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 123.841 0.856 . . . . 0.0 111.967 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -63.18 -44.7 94.69 Favored 'General case' 0 C--N 1.387 2.227 0 C-N-CA 125.078 1.351 . . . . 0.0 107.671 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.644 HD21 HD21 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -64.16 -36.26 83.47 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.669 1.231 . . . . 0.0 114.096 177.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.72 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 43.6 t90 -63.62 -27.37 69.19 Favored 'General case' 0 CA--C 1.571 1.785 0 CA-C-O 117.822 -1.085 . . . . 0.0 112.753 172.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 26.4 t60 -85.5 -23.84 27.59 Favored 'General case' 0 CA--C 1.58 2.117 0 CA-C-N 120.101 1.319 . . . . 0.0 109.525 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.22 -40.59 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 125.15 1.531 . . . . 0.0 108.389 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.15 -28.37 38.86 Favored 'General case' 0 C--N 1.378 1.828 0 C-N-CA 123.562 0.745 . . . . 0.0 112.001 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.3 OUTLIER -86.96 -0.14 56.08 Favored 'General case' 0 C--N 1.4 2.768 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 176.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 2.7 tpt180 -96.7 -27.27 14.85 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 129.302 3.041 . . . . 0.0 106.592 172.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -82.78 -45.96 13.71 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 126.203 1.801 . . . . 0.0 110.7 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.59 85.14 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 124.398 1.079 . . . . 0.0 113.144 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -72.44 -7.15 48.32 Favored 'General case' 0 N--CA 1.515 2.818 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 178.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -104.54 -6.36 20.66 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 128.414 2.686 . . . . 0.0 111.017 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.357 8.9 mt-10 67.24 46.49 1.47 Allowed 'General case' 0 N--CA 1.521 3.099 0 C-N-CA 128.268 2.627 . . . . 0.0 114.776 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.4 -1.2 14.26 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.005 -2.361 . . . . 0.0 107.405 174.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -96.85 110.12 3.98 Favored Glycine 0 C--N 1.365 2.157 0 CA-C-N 111.575 -2.557 . . . . 0.0 111.255 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.81 178.44 5.14 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 112.981 -1.61 . . . . 0.0 112.628 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.36 92.21 Favored Pre-proline 0 CA--C 1.589 2.455 0 CA-C-O 116.359 -1.782 . . . . 0.0 112.762 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -72.22 -3.0 12.51 Favored 'Trans proline' 1 C--N 1.446 5.672 0 C-N-CA 123.744 2.963 . . . . 0.0 116.535 173.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -108.53 -30.88 8.03 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -173.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -30.99 31.51 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 127.608 2.363 . . . . 0.0 109.94 176.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -51.97 67.59 Favored 'General case' 0 N--CA 1.51 2.57 0 C-N-CA 125.553 1.541 . . . . 0.0 110.431 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -62.82 -44.93 94.83 Favored 'General case' 0 C--N 1.405 2.993 0 O-C-N 125.452 1.72 . . . . 0.0 110.934 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 1.0 OUTLIER -58.15 -52.29 66.18 Favored 'General case' 0 C--N 1.401 2.81 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 176.383 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -55.89 -53.29 58.54 Favored 'General case' 0 C--N 1.416 3.483 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -56.05 -42.16 76.18 Favored 'General case' 0 C--N 1.406 3.054 0 O-C-N 124.553 1.158 . . . . 0.0 112.854 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.16 -13.99 54.41 Favored 'General case' 0 C--N 1.386 2.189 0 CA-C-N 114.261 -1.336 . . . . 0.0 113.306 -178.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.72 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 65.5 mt-30 -70.35 -41.8 72.7 Favored 'General case' 0 C--N 1.414 3.411 0 CA-C-N 120.268 1.394 . . . . 0.0 109.214 -178.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -73.03 -22.94 60.55 Favored 'General case' 0 C--N 1.391 2.41 0 C-N-CA 125.449 1.5 . . . . 0.0 112.964 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.4 t -79.72 -42.79 23.88 Favored 'General case' 0 C--N 1.386 2.155 0 CA-C-N 112.379 -2.191 . . . . 0.0 109.963 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -46.24 74.25 Favored 'General case' 0 C--N 1.387 2.2 0 C-N-CA 125.248 1.419 . . . . 0.0 112.106 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -71.29 -37.56 71.83 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 126.816 2.046 . . . . 0.0 111.772 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.09 -31.89 82.36 Favored Glycine 0 C--N 1.394 3.805 0 CA-C-N 120.179 1.354 . . . . 0.0 113.405 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -72.16 -28.53 63.3 Favored 'General case' 0 C--N 1.386 2.191 0 CA-C-N 112.527 -1.837 . . . . 0.0 109.414 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.25 -38.66 96.84 Favored Glycine 1 C--N 1.406 4.471 0 CA-C-N 119.367 0.985 . . . . 0.0 115.19 173.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.7 m -59.33 -49.09 79.14 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 126.111 1.765 . . . . 0.0 113.095 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -68.13 0.21 Allowed 'General case' 0 C--N 1.4 2.791 0 C-N-CA 127.611 2.364 . . . . 0.0 113.792 176.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.253 9.1 mt -72.74 -14.04 61.46 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.76 49.87 9.94 Favored Glycine 0 C--N 1.366 2.229 0 N-CA-C 118.332 2.093 . . . . 0.0 118.332 172.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.53 137.03 53.93 Favored 'General case' 0 C--O 1.257 1.491 0 CA-C-N 119.877 1.839 . . . . 0.0 109.948 -178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.19 120.09 14.48 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.341 0.656 . . . . 0.0 110.047 174.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.527 ' O ' HG23 ' B' ' 158' ' ' THR . 0.6 OUTLIER -55.92 -43.18 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.674 1.99 . . . . 0.0 114.225 -178.117 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -63.78 -44.84 92.18 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.8 t -72.52 -28.32 62.79 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 123.817 0.847 . . . . 0.0 110.408 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.69 -26.4 60.71 Favored 'General case' 0 C--N 1.376 1.725 0 O-C-N 124.539 1.15 . . . . 0.0 111.426 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 154' ' ' ILE . 33.3 p -68.35 -15.98 63.76 Favored 'General case' 0 C--N 1.421 3.706 0 CA-C-O 122.272 1.034 . . . . 0.0 113.215 175.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -104.64 -40.12 6.12 Favored 'General case' 0 N--CA 1.515 2.779 0 CA-C-N 112.054 -2.339 . . . . 0.0 109.697 -174.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.36 -48.38 80.05 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 126.264 1.826 . . . . 0.0 110.486 173.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -72.85 -28.93 65.98 Favored Glycine 0 C--N 1.395 3.839 0 CA-C-O 117.283 -1.843 . . . . 0.0 115.123 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -47.78 -48.79 30.05 Favored 'General case' 0 N--CA 1.509 2.483 0 CA-C-N 118.27 1.035 . . . . 0.0 112.163 170.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.59 -35.6 77.58 Favored 'General case' 0 C--N 1.393 2.484 0 C-N-CA 125.759 1.623 . . . . 0.0 112.637 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.454 0.9 OUTLIER -68.41 -56.14 13.61 Favored 'Isoleucine or valine' 0 C--N 1.383 2.037 0 CA-C-O 115.673 -2.108 . . . . 0.0 112.011 179.535 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 8.7 t -50.51 -49.77 23.68 Favored 'Isoleucine or valine' 1 N--CA 1.551 4.583 0 CA-C-N 121.29 1.859 . . . . 0.0 111.214 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -53.44 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 126.324 2.265 . . . . 0.0 108.867 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -47.97 -40.69 23.12 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 173.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.309 1.7 pp -68.16 -9.44 11.04 Favored 'Isoleucine or valine' 1 N--CA 1.542 4.147 0 CA-C-N 124.12 3.145 . . . . 0.0 115.256 -179.842 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.27 -25.68 14.42 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -83.8 -15.46 48.28 Favored 'General case' 0 N--CA 1.519 3.018 0 CA-C-O 123.337 1.542 . . . . 0.0 111.363 175.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -89.0 14.59 10.24 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 129.407 3.083 . . . . 0.0 113.55 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -99.32 -15.67 18.73 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.386 2.171 0 C-N-CA 124.137 0.975 . . . . 0.0 112.007 -178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 119.362 -0.352 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.66 107.78 0.05 OUTLIER 'General case' 0 N--CA 1.523 3.2 0 C-N-CA 126.73 2.012 . . . . 0.0 113.032 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 51.1 m -99.53 -42.7 6.81 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 127.289 2.236 . . . . 0.0 114.973 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -84.98 -12.17 53.87 Favored 'General case' 0 N--CA 1.512 2.662 0 CA-C-N 120.822 1.646 . . . . 0.0 114.175 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 m -92.57 -21.3 20.16 Favored 'General case' 0 CA--C 1.584 2.265 0 C-N-CA 125.218 1.407 . . . . 0.0 109.401 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.4 t -88.78 -38.68 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 68.2 m -68.68 -32.86 72.98 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 124.441 1.097 . . . . 0.0 111.457 174.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 98.1 p -74.45 -16.16 60.87 Favored 'General case' 0 C--N 1.394 2.516 0 C-N-CA 124.327 1.051 . . . . 0.0 112.251 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -88.29 -39.03 14.71 Favored 'General case' 0 CA--C 1.572 1.823 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -65.85 -35.51 80.86 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 125.097 1.359 . . . . 0.0 112.507 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.569 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.91 -37.86 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-O 117.542 -1.218 . . . . 0.0 110.706 173.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -30.86 71.88 Favored 'General case' 0 C--N 1.384 2.089 0 CA-C-N 119.349 0.977 . . . . 0.0 111.906 176.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.88 -41.37 74.87 Favored 'General case' 0 C--N 1.392 2.418 0 C-N-CA 123.063 0.545 . . . . 0.0 111.74 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -71.65 -49.57 38.73 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-O 117.85 -1.071 . . . . 0.0 110.647 176.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.11 -38.72 87.33 Favored 'General case' 0 C--N 1.383 2.038 0 C-N-CA 124.208 1.003 . . . . 0.0 112.551 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -70.91 -25.28 62.7 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.53 -22.5 40.81 Favored 'General case' 0 N--CA 1.506 2.356 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 177.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -73.12 -40.71 58.58 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.034 0 O-C-N 125.558 1.786 . . . . 0.0 107.444 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.36 -28.19 59.44 Favored 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 124.148 0.979 . . . . 0.0 112.184 176.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -85.65 -13.99 46.92 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 123.854 0.862 . . . . 0.0 112.627 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.2 mtt180 -88.16 -21.51 24.56 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 127.93 2.492 . . . . 0.0 106.982 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -85.73 -45.62 11.47 Favored 'General case' 0 CA--C 1.578 2.03 0 C-N-CA 126.95 2.1 . . . . 0.0 110.746 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.42 86.22 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.225 1.01 . . . . 0.0 113.481 176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.26 -9.11 58.36 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.24 -9.85 19.23 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 128.528 2.731 . . . . 0.0 110.833 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.283 11.8 mt-10 63.17 58.54 1.41 Allowed 'General case' 0 N--CA 1.522 3.145 0 C-N-CA 128.118 2.567 . . . . 0.0 114.176 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -107.89 17.38 22.53 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 127.117 2.167 . . . . 0.0 109.835 178.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.43 168.86 30.97 Favored Glycine 0 C--O 1.243 0.717 0 CA-C-N 109.432 -3.531 . . . . 0.0 114.011 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.52 -151.33 0.48 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.293 1.437 . . . . 0.0 108.23 -178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.1 -43.7 91.58 Favored Pre-proline 0 CA--C 1.599 2.854 0 CA-C-O 115.69 -2.1 . . . . 0.0 113.409 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -50.27 -40.38 52.27 Favored 'Trans proline' 1 C--N 1.463 6.599 0 C-N-CA 124.318 3.346 . . . . 0.0 117.864 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.77 -44.81 63.39 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 120.53 1.513 . . . . 0.0 112.351 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.08 -37.19 81.8 Favored 'General case' 0 N--CA 1.515 2.789 0 C-N-CA 125.956 1.703 . . . . 0.0 112.111 174.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -52.09 66.91 Favored 'General case' 0 N--CA 1.517 2.885 0 C-N-CA 126.676 1.991 . . . . 0.0 112.081 173.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.38 -44.03 97.41 Favored 'General case' 0 C--N 1.394 2.533 0 C-N-CA 126.753 2.021 . . . . 0.0 111.658 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -47.7 72.66 Favored 'General case' 0 C--N 1.395 2.553 0 N-CA-C 115.91 1.818 . . . . 0.0 115.91 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -62.44 -43.1 99.63 Favored 'General case' 0 C--N 1.391 2.392 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -176.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -63.85 -49.96 70.72 Favored 'General case' 0 C--N 1.396 2.598 0 CA-C-N 112.403 -2.181 . . . . 0.0 111.7 -175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.42 -16.68 51.38 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 112.984 -1.916 . . . . 0.0 112.688 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -66.8 -42.4 86.03 Favored 'General case' 0 C--N 1.405 2.983 0 CA-C-N 119.208 0.913 . . . . 0.0 110.241 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.49 -24.16 61.93 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 125.211 1.404 . . . . 0.0 112.044 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -79.43 -44.64 21.0 Favored 'General case' 0 C--N 1.392 2.432 0 CA-C-N 112.337 -2.211 . . . . 0.0 110.062 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.48 70.23 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 125.576 1.55 . . . . 0.0 113.47 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -71.04 -37.84 72.54 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 126.082 1.753 . . . . 0.0 111.616 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.66 -24.44 76.26 Favored Glycine 0 C--N 1.388 3.468 0 CA-C-N 119.809 1.186 . . . . 0.0 113.477 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 mtt180 -74.93 -29.34 60.93 Favored 'General case' 0 C--N 1.39 2.328 0 C-N-CA 125.223 1.409 . . . . 0.0 108.511 173.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.89 -37.92 95.69 Favored Glycine 1 C--N 1.405 4.397 0 C-N-CA 123.826 0.727 . . . . 0.0 114.738 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.51 -49.73 76.67 Favored 'General case' 0 C--N 1.38 1.895 0 C-N-CA 126.488 1.915 . . . . 0.0 113.376 178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -60.78 3.03 Favored 'General case' 0 C--N 1.4 2.761 0 C-N-CA 126.751 2.021 . . . . 0.0 114.858 177.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.268 33.5 mt -78.84 -12.06 60.01 Favored 'General case' 0 N--CA 1.511 2.595 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.78 46.2 24.79 Favored Glycine 0 C--N 1.363 2.046 0 N-CA-C 118.231 2.052 . . . . 0.0 118.231 172.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.39 133.61 54.63 Favored 'General case' 0 C--O 1.258 1.529 0 CA-C-N 119.999 1.899 . . . . 0.0 109.16 -178.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.74 119.53 14.11 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.887 0.851 . . . . 0.0 109.557 175.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 58' ' ' THR 0.257 0.5 OUTLIER -56.28 -41.87 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 127.474 2.309 . . . . 0.0 115.346 -176.207 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.81 -40.71 98.21 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 119.677 1.126 . . . . 0.0 112.808 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.79 -32.07 61.91 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.627 1.171 . . . . 0.0 109.63 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -28.24 62.92 Favored 'General case' 0 C--N 1.378 1.805 0 O-C-N 124.707 1.255 . . . . 0.0 111.825 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -68.48 -18.63 64.44 Favored 'General case' 0 C--N 1.408 3.146 0 CA-C-O 122.818 1.294 . . . . 0.0 111.612 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -98.58 -44.61 6.39 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 111.432 -2.622 . . . . 0.0 110.471 -175.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.52 89.2 Favored 'General case' 0 C--N 1.377 1.782 0 C-N-CA 126.695 1.998 . . . . 0.0 110.313 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.671 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -74.03 -27.39 66.59 Favored Glycine 0 C--N 1.391 3.596 0 CA-C-O 116.996 -2.002 . . . . 0.0 114.386 173.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -47.64 -46.19 28.55 Favored 'General case' 0 N--CA 1.517 2.904 0 CA-C-N 119.182 1.491 . . . . 0.0 112.227 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 56.1 mt-30 -66.86 -36.29 81.99 Favored 'General case' 0 C--N 1.394 2.507 0 C-N-CA 125.221 1.409 . . . . 0.0 112.108 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.685 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.362 0.9 OUTLIER -76.03 -15.34 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 C-N-CA 124.948 1.299 . . . . 0.0 113.285 -179.998 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.569 HG22 HG12 ' A' ' 11' ' ' VAL . 87.7 t -93.21 -59.4 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 124.342 1.057 . . . . 0.0 108.168 177.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.3 -70.52 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 125.94 2.025 . . . . 0.0 110.254 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 97.8 mtt180 -54.95 -39.52 68.99 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-O 115.143 -2.36 . . . . 0.0 117.193 173.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.291 0.1 OUTLIER -66.7 -17.32 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.094 0 CA-C-N 122.785 2.539 . . . . 0.0 114.572 179.925 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 mp -91.28 -29.75 16.99 Favored 'General case' 0 CA--C 1.583 2.244 0 C-N-CA 122.49 0.316 . . . . 0.0 110.646 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -82.14 -11.39 58.76 Favored 'General case' 0 N--CA 1.527 3.381 0 CA-C-O 123.416 1.579 . . . . 0.0 112.013 175.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -89.08 18.01 5.34 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 110.203 -3.181 . . . . 0.0 113.503 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -101.28 -19.84 15.49 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.109 0 C-N-CA 123.988 0.915 . . . . 0.0 111.563 -178.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.6 107.52 0.05 OUTLIER 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 126.742 2.017 . . . . 0.0 112.942 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 53.4 m -99.41 -41.62 7.33 Favored 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 127.282 2.233 . . . . 0.0 114.901 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -87.14 -7.57 57.86 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.822 1.646 . . . . 0.0 114.237 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.6 m -98.52 -18.34 18.23 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 125.296 1.439 . . . . 0.0 109.102 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 5.3 t -91.41 -38.18 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 69.6 m -69.24 -32.77 72.22 Favored 'General case' 0 C--N 1.387 2.213 0 C-N-CA 124.352 1.061 . . . . 0.0 111.356 174.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 97.3 p -75.76 -13.16 60.29 Favored 'General case' 0 C--N 1.397 2.657 0 CA-C-N 119.132 0.878 . . . . 0.0 112.463 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -90.54 -38.8 12.95 Favored 'General case' 0 C--N 1.376 1.742 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 175.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -65.85 -35.51 80.88 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 125.077 1.351 . . . . 0.0 112.44 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . 0.558 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -72.07 -37.93 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.641 173.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.81 -30.8 71.82 Favored 'General case' 0 C--N 1.384 2.076 0 CA-C-N 119.403 1.001 . . . . 0.0 111.951 176.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 93.8 m -69.86 -41.41 74.88 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 123.044 0.538 . . . . 0.0 111.685 177.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.72 -49.64 37.49 Favored 'General case' 0 C--N 1.394 2.539 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.624 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 mp -61.0 -38.72 87.04 Favored 'General case' 0 C--N 1.382 2.017 0 C-N-CA 124.193 0.997 . . . . 0.0 112.439 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -71.08 -25.23 62.53 Favored 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 172.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -80.41 -22.72 40.95 Favored 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 119.556 1.071 . . . . 0.0 108.387 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 78.1 t -72.97 -40.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.028 0 O-C-N 125.586 1.804 . . . . 0.0 107.367 174.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -75.52 -27.84 58.89 Favored 'General case' 0 CA--C 1.578 2.051 0 C-N-CA 124.07 0.948 . . . . 0.0 112.054 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -87.95 -8.63 55.45 Favored 'General case' 0 C--N 1.398 2.69 0 C-N-CA 123.488 0.715 . . . . 0.0 112.9 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 21.4 mtt180 -92.67 -21.13 20.18 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 128.317 2.647 . . . . 0.0 106.671 174.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -86.26 -45.83 10.91 Favored 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.87 2.068 . . . . 0.0 110.713 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.09 -40.41 86.95 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 124.242 1.017 . . . . 0.0 113.552 176.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -9.28 58.54 Favored 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -103.28 -9.88 19.16 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 128.525 2.73 . . . . 0.0 110.87 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.279 11.9 mt-10 62.99 59.33 1.35 Allowed 'General case' 0 N--CA 1.521 3.109 0 C-N-CA 128.202 2.601 . . . . 0.0 114.141 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -108.61 17.4 22.01 Favored 'General case' 0 N--CA 1.51 2.533 0 C-N-CA 127.132 2.173 . . . . 0.0 109.811 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -151.45 168.78 30.97 Favored Glycine 0 C--O 1.243 0.716 0 CA-C-N 109.444 -3.526 . . . . 0.0 114.016 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.54 -151.31 0.48 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.246 1.419 . . . . 0.0 108.275 -178.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.15 -43.68 91.28 Favored Pre-proline 0 CA--C 1.6 2.89 0 CA-C-O 115.73 -2.081 . . . . 0.0 113.356 175.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -50.37 -40.41 53.1 Favored 'Trans proline' 1 C--N 1.463 6.602 0 C-N-CA 124.361 3.374 . . . . 0.0 117.719 176.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.75 -44.83 63.4 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 120.675 1.579 . . . . 0.0 112.309 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -37.26 81.83 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 125.875 1.67 . . . . 0.0 112.102 174.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -52.14 66.68 Favored 'General case' 0 N--CA 1.519 2.989 0 C-N-CA 126.647 1.979 . . . . 0.0 111.997 173.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -62.24 -44.11 97.3 Favored 'General case' 0 C--N 1.394 2.502 0 C-N-CA 126.862 2.065 . . . . 0.0 111.65 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -47.75 72.49 Favored 'General case' 0 C--N 1.396 2.602 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -62.28 -43.17 99.45 Favored 'General case' 0 C--N 1.392 2.449 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -63.92 -49.98 70.51 Favored 'General case' 0 C--N 1.396 2.615 0 CA-C-N 112.298 -2.228 . . . . 0.0 111.635 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.99 -15.26 54.31 Favored 'General case' 0 C--N 1.375 1.711 0 CA-C-N 113.018 -1.901 . . . . 0.0 112.693 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -67.6 -42.4 82.49 Favored 'General case' 0 C--N 1.405 2.995 0 CA-C-N 119.251 0.932 . . . . 0.0 110.17 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -71.39 -24.35 62.05 Favored 'General case' 0 C--N 1.388 2.253 0 C-N-CA 125.303 1.441 . . . . 0.0 112.07 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.5 t -79.22 -44.63 21.44 Favored 'General case' 0 C--N 1.394 2.508 0 CA-C-N 112.267 -2.242 . . . . 0.0 110.091 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -45.51 70.22 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.525 1.53 . . . . 0.0 113.478 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -71.04 -37.76 72.54 Favored 'General case' 0 C--N 1.385 2.151 0 C-N-CA 126.03 1.732 . . . . 0.0 111.741 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.65 -24.45 76.25 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-N 119.69 1.132 . . . . 0.0 113.475 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -74.8 -29.29 61.05 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.234 1.414 . . . . 0.0 108.484 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.96 95.77 Favored Glycine 1 C--N 1.407 4.499 0 C-N-CA 123.829 0.728 . . . . 0.0 114.791 173.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.8 m -59.26 -49.71 76.8 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 126.479 1.911 . . . . 0.0 113.159 178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -70.11 0.1 Allowed 'General case' 0 C--N 1.398 2.692 0 C-N-CA 127.632 2.373 . . . . 0.0 113.989 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.257 34.1 mt -72.38 -13.75 61.55 Favored 'General case' 0 N--CA 1.511 2.577 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.24 49.09 13.03 Favored Glycine 0 C--N 1.367 2.298 0 N-CA-C 118.337 2.095 . . . . 0.0 118.337 172.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.18 133.59 53.51 Favored 'General case' 0 C--O 1.258 1.508 0 CA-C-N 119.748 1.774 . . . . 0.0 109.189 -178.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 119.22 13.42 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.759 0.79 . . . . 0.0 109.642 175.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.561 ' O ' HG23 ' B' ' 158' ' ' THR 0.261 0.5 OUTLIER -55.8 -42.26 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 C-N-CA 127.453 2.301 . . . . 0.0 115.402 -176.265 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.64 -41.04 98.81 Favored 'General case' 0 N--CA 1.516 2.841 0 CA-C-N 119.661 1.119 . . . . 0.0 112.81 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -32.07 63.04 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.585 1.154 . . . . 0.0 109.496 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.66 -27.87 62.37 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 124.806 1.316 . . . . 0.0 111.745 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.561 HG23 ' O ' ' B' ' 154' ' ' ILE . 48.8 p -70.3 -11.67 61.06 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.671 1.224 . . . . 0.0 112.35 174.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -107.94 -42.87 4.57 Favored 'General case' 0 N--CA 1.511 2.583 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.947 -174.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.4 -46.59 87.89 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 126.347 1.859 . . . . 0.0 109.85 172.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . 0.692 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.8 -28.1 65.65 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-O 117.065 -1.964 . . . . 0.0 114.503 173.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -47.19 -45.82 23.35 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 119.062 1.431 . . . . 0.0 112.232 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.541 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 56.1 mt-30 -67.17 -36.12 81.11 Favored 'General case' 0 C--N 1.392 2.438 0 C-N-CA 125.152 1.381 . . . . 0.0 112.023 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.692 HG12 ' HA2' ' B' ' 161' ' ' GLY 0.308 0.8 OUTLIER -79.57 -4.3 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.603 0 C-N-CA 124.689 1.195 . . . . 0.0 113.979 -179.429 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . 0.558 HG22 HG12 ' B' ' 111' ' ' VAL . 84.7 t -104.31 -58.63 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -53.01 -78.02 0.02 OUTLIER 'General case' 0 C--N 1.372 1.567 0 O-C-N 126.001 2.063 . . . . 0.0 108.358 177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 98.0 mtt180 -49.32 -40.39 34.98 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-O 114.817 -2.516 . . . . 0.0 117.163 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.571 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.256 0.1 OUTLIER -69.16 -9.38 11.95 Favored 'Isoleucine or valine' 0 C--N 1.416 3.491 0 CA-C-N 123.485 2.857 . . . . 0.0 115.095 -179.637 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 mp -98.69 -28.59 13.46 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 122.936 0.494 . . . . 0.0 110.261 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -82.77 -11.11 58.53 Favored 'General case' 0 N--CA 1.521 3.12 0 CA-C-O 123.546 1.641 . . . . 0.0 111.543 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -89.16 18.87 4.64 Favored 'General case' 0 N--CA 1.513 2.696 0 CA-C-N 110.256 -3.157 . . . . 0.0 113.596 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -102.35 -19.45 14.98 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -174.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.385 2.145 0 C-N-CA 124.012 0.925 . . . . 0.0 111.619 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.462 0.649 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.11 112.62 24.9 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 122.39 1.09 . . . . 0.0 112.132 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.2 m -102.21 -44.33 5.46 Favored 'General case' 0 N--CA 1.498 1.929 0 C-N-CA 127.269 2.228 . . . . 0.0 114.625 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -85.65 -14.15 46.41 Favored 'General case' 0 N--CA 1.509 2.488 0 CA-C-N 121.079 1.763 . . . . 0.0 114.38 -178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -91.97 -22.72 19.85 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 125.087 1.355 . . . . 0.0 109.139 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 t -88.31 -39.36 12.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.446 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.4 m -68.63 -30.3 68.99 Favored 'General case' 0 C--N 1.388 2.255 0 C-N-CA 123.704 0.802 . . . . 0.0 111.321 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -77.33 -17.18 58.5 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.235 1.014 . . . . 0.0 111.866 174.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -88.83 -44.73 10.28 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 118.706 -0.664 . . . . 0.0 109.579 176.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.48 -39.68 94.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 125.618 1.567 . . . . 0.0 111.896 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -72.14 -38.19 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 124.508 1.123 . . . . 0.0 110.686 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 16' ' ' TRP . 0.2 OUTLIER -67.5 -28.08 67.54 Favored 'General case' 0 C--N 1.389 2.284 0 CA-C-N 118.892 0.769 . . . . 0.0 111.671 174.4 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.1 m -67.14 -39.83 86.64 Favored 'General case' 0 C--N 1.392 2.44 0 C-N-CA 124.476 1.111 . . . . 0.0 110.725 174.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -66.26 -47.25 74.32 Favored 'General case' 0 C--N 1.385 2.135 0 C-N-CA 125.303 1.441 . . . . 0.0 109.968 174.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.39 -21.24 65.6 Favored 'General case' 0 C--N 1.379 1.851 0 C-N-CA 124.048 0.939 . . . . 0.0 112.659 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -80.87 -31.03 35.49 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 114.098 -1.41 . . . . 0.0 112.208 175.78 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -83.37 -21.91 32.94 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.903 0.881 . . . . 0.0 108.861 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.03 -41.28 52.52 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.223 0 O-C-N 125.055 1.472 . . . . 0.0 107.998 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' HB3' HD11 ' A' ' 36' ' ' LEU . 66.7 mtt180 -75.54 -31.1 59.96 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.047 0.939 . . . . 0.0 112.958 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -84.02 -11.14 57.23 Favored 'General case' 0 N--CA 1.509 2.51 0 C-N-CA 123.928 0.891 . . . . 0.0 113.171 177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -85.33 -18.97 32.23 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.956 2.502 . . . . 0.0 106.751 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -46.41 9.28 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 125.507 1.523 . . . . 0.0 111.988 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.51 84.84 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 124.807 1.243 . . . . 0.0 114.144 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.31 -5.96 39.86 Favored 'General case' 0 N--CA 1.522 3.126 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -102.7 -4.06 25.62 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 128.965 2.906 . . . . 0.0 110.541 176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 58.02 44.42 19.54 Favored 'General case' 0 N--CA 1.538 3.948 0 C-N-CA 127.857 2.463 . . . . 0.0 112.536 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.74 7.96 20.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 111.648 -2.524 . . . . 0.0 113.859 -176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -132.36 152.48 20.23 Favored Glycine 0 C--N 1.365 2.192 0 N-CA-C 108.254 -1.938 . . . . 0.0 108.254 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.4 -172.01 2.42 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.864 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -42.13 74.01 Favored Pre-proline 0 C--N 1.388 2.248 0 CA-C-O 115.732 -2.08 . . . . 0.0 115.052 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.26 -36.93 94.58 Favored 'Trans proline' 1 C--N 1.451 5.932 0 CA-C-N 123.435 2.262 . . . . 0.0 115.156 175.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -54.6 39.7 Favored 'General case' 0 C--N 1.395 2.575 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.62 -35.73 62.93 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.443 1.497 . . . . 0.0 113.232 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.55 -51.62 69.13 Favored 'General case' 0 N--CA 1.512 2.646 0 C-N-CA 125.061 1.344 . . . . 0.0 111.845 175.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.6 -41.7 92.46 Favored 'General case' 0 C--N 1.39 2.336 0 C-N-CA 125.659 1.584 . . . . 0.0 111.749 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' A' ' 19' ' ' ARG . 1.9 mp -58.39 -49.73 76.19 Favored 'General case' 0 C--N 1.396 2.621 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.09 -42.48 99.26 Favored 'General case' 0 N--CA 1.513 2.711 0 C-N-CA 125.642 1.577 . . . . 0.0 114.993 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -64.11 -48.75 74.9 Favored 'General case' 0 C--N 1.391 2.404 0 CA-C-N 112.078 -2.328 . . . . 0.0 110.577 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.0 -16.7 52.68 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.957 -1.929 . . . . 0.0 113.205 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.43 -42.51 78.78 Favored 'General case' 0 C--N 1.411 3.244 0 CA-C-N 119.563 1.074 . . . . 0.0 110.72 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -71.45 -22.56 61.82 Favored 'General case' 0 C--N 1.385 2.134 0 C-N-CA 124.811 1.245 . . . . 0.0 111.713 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.68 21.65 Favored 'General case' 0 C--N 1.392 2.429 0 CA-C-N 112.536 -2.12 . . . . 0.0 109.554 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -49.12 61.04 Favored 'General case' 0 C--N 1.396 2.62 0 C-N-CA 125.512 1.525 . . . . 0.0 112.878 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.75 -37.03 76.3 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 126.086 1.754 . . . . 0.0 111.443 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.43 -26.35 74.34 Favored Glycine 0 C--N 1.388 3.469 0 CA-C-N 119.413 1.006 . . . . 0.0 113.395 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -76.26 -29.68 57.57 Favored 'General case' 0 C--N 1.391 2.377 0 C-N-CA 125.235 1.414 . . . . 0.0 109.626 173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.48 -35.98 92.77 Favored Glycine 1 C--N 1.405 4.379 0 CA-C-N 119.02 0.827 . . . . 0.0 114.006 173.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -60.13 -49.26 78.32 Favored 'General case' 0 CA--C 1.575 1.926 0 C-N-CA 126.194 1.797 . . . . 0.0 113.088 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.86 -59.71 4.83 Favored 'General case' 0 N--CA 1.517 2.888 0 C-N-CA 127.115 2.166 . . . . 0.0 114.164 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 14.1 mt -79.09 -13.52 59.7 Favored 'General case' 0 N--CA 1.512 2.666 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.51 46.42 12.0 Favored Glycine 0 C--N 1.362 2.01 0 N-CA-C 118.249 2.06 . . . . 0.0 118.249 172.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.85 133.59 54.42 Favored 'General case' 0 C--N 1.37 1.459 0 CA-C-N 120.496 2.148 . . . . 0.0 109.439 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.2 122.31 18.56 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.942 0.877 . . . . 0.0 109.995 174.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.438 ' O ' HG23 ' A' ' 58' ' ' THR 0.261 0.6 OUTLIER -57.79 -43.31 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.181 0 C-N-CA 127.475 2.31 . . . . 0.0 116.285 -176.103 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.11 -40.62 98.16 Favored 'General case' 0 N--CA 1.521 3.078 0 CA-C-N 119.253 0.933 . . . . 0.0 113.356 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -30.47 63.27 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 124.8 1.24 . . . . 0.0 109.617 177.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.52 63.89 Favored 'General case' 0 C--N 1.374 1.633 0 O-C-N 125.08 1.488 . . . . 0.0 111.747 176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 54' ' ' ILE . 44.6 p -67.08 -19.09 65.59 Favored 'General case' 0 C--N 1.407 3.084 0 CA-C-N 119.637 1.108 . . . . 0.0 112.419 175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -98.63 -44.08 6.58 Favored 'General case' 0 N--CA 1.518 2.941 0 CA-C-N 111.567 -2.561 . . . . 0.0 111.377 -175.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.68 89.53 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 126.846 2.058 . . . . 0.0 110.312 174.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.06 -32.55 60.46 Favored Glycine 0 C--N 1.381 3.075 0 CA-C-O 116.364 -2.353 . . . . 0.0 114.609 173.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.4 -49.61 17.75 Favored 'General case' 0 N--CA 1.524 3.227 0 CA-C-N 119.567 1.683 . . . . 0.0 112.374 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -66.24 -36.65 83.57 Favored 'General case' 0 C--N 1.389 2.291 0 C-N-CA 125.645 1.578 . . . . 0.0 112.485 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.262 57.0 mt -64.45 -53.76 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 CA-C-O 116.412 -1.756 . . . . 0.0 110.691 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.72 -47.97 61.36 Favored 'Isoleucine or valine' 1 N--CA 1.55 4.559 0 CA-C-N 120.24 1.382 . . . . 0.0 112.328 175.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -59.5 -74.38 0.07 Allowed 'General case' 0 CA--C 1.576 1.946 0 O-C-N 125.71 1.881 . . . . 0.0 111.174 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -52.64 -38.44 60.34 Favored 'General case' 0 N--CA 1.515 2.786 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 172.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.298 1.2 pp -70.02 -17.62 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.53 3.57 0 CA-C-N 122.432 2.378 . . . . 0.0 114.418 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -22.71 20.74 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 123.513 0.508 . . . . 0.0 110.229 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -86.66 -9.32 56.27 Favored 'General case' 0 CA--C 1.594 2.663 0 CA-C-O 122.477 1.132 . . . . 0.0 111.077 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -93.87 -48.74 6.14 Favored 'General case' 0 N--CA 1.508 2.458 0 CA-C-N 111.927 -2.397 . . . . 0.0 113.304 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -147.77 133.33 18.74 Favored 'General case' 0 C--N 1.394 2.506 0 C-N-CA 127.22 2.208 . . . . 0.0 107.256 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 122.296 2.316 . . . . 0.0 112.155 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.525 0.679 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.83 112.36 24.57 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 122.501 1.143 . . . . 0.0 112.089 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 23.0 m -102.18 -43.14 5.81 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 127.298 2.239 . . . . 0.0 114.586 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -87.35 -11.3 49.79 Favored 'General case' 0 N--CA 1.511 2.616 0 CA-C-N 120.941 1.7 . . . . 0.0 114.353 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 3.0 m -96.32 -20.35 18.57 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 125.05 1.34 . . . . 0.0 108.773 177.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.42 -38.66 11.16 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.8 m -69.44 -29.42 67.11 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 123.51 0.724 . . . . 0.0 111.285 173.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 4.3 m -78.81 -14.47 59.24 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 123.829 0.851 . . . . 0.0 112.018 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -91.05 -44.62 9.19 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-O 118.757 -0.64 . . . . 0.0 109.424 176.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -64.54 -39.7 94.25 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 125.462 1.505 . . . . 0.0 111.791 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.18 -38.29 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 C-N-CA 124.548 1.139 . . . . 0.0 110.669 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' B' ' 116' ' ' TRP . 0.2 OUTLIER -67.5 -27.92 67.41 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 118.965 0.802 . . . . 0.0 111.65 174.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.4 m -67.21 -39.82 86.34 Favored 'General case' 0 C--N 1.392 2.455 0 C-N-CA 124.478 1.111 . . . . 0.0 110.757 174.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -66.39 -47.1 74.41 Favored 'General case' 0 C--N 1.387 2.232 0 C-N-CA 125.289 1.436 . . . . 0.0 110.009 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mp -67.41 -21.16 65.59 Favored 'General case' 0 C--N 1.379 1.884 0 C-N-CA 124.034 0.934 . . . . 0.0 112.695 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.412 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 0.0 OUTLIER -81.13 -30.81 34.43 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 113.963 -1.472 . . . . 0.0 112.261 175.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -83.59 -22.04 32.41 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.794 0.838 . . . . 0.0 108.816 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 55.9 t -73.64 -41.23 55.3 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.199 0 O-C-N 125.08 1.487 . . . . 0.0 107.815 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . 0.436 ' HB3' HD11 ' B' ' 136' ' ' LEU . 66.3 mtt180 -75.73 -30.83 59.37 Favored 'General case' 0 CA--C 1.579 2.075 0 C-N-CA 123.938 0.895 . . . . 0.0 112.89 178.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 17.0 tttt -86.99 -3.96 59.14 Favored 'General case' 0 C--N 1.397 2.674 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -91.35 -17.42 25.91 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 128.602 2.761 . . . . 0.0 106.432 172.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -90.47 -45.93 8.66 Favored 'General case' 0 CA--C 1.571 1.758 0 C-N-CA 125.392 1.477 . . . . 0.0 111.6 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.18 83.77 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 124.599 1.16 . . . . 0.0 114.015 178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.71 -3.56 29.06 Favored 'General case' 0 N--CA 1.522 3.128 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -104.46 -3.86 23.47 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.04 2.936 . . . . 0.0 110.542 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 58.06 44.15 19.8 Favored 'General case' 0 N--CA 1.536 3.836 0 C-N-CA 127.791 2.437 . . . . 0.0 112.633 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.68 7.93 20.57 Favored 'General case' 0 C--O 1.249 1.077 0 CA-C-N 111.617 -2.538 . . . . 0.0 113.845 -176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -132.16 152.41 20.17 Favored Glycine 0 C--N 1.365 2.168 0 N-CA-C 108.135 -1.986 . . . . 0.0 108.135 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -172.07 2.45 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.83 -178.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -50.63 -42.07 74.05 Favored Pre-proline 0 C--N 1.39 2.36 0 CA-C-O 115.718 -2.086 . . . . 0.0 115.073 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -55.21 -36.95 94.49 Favored 'Trans proline' 1 C--N 1.45 5.901 0 CA-C-N 123.4 2.25 . . . . 0.0 115.201 175.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -54.75 38.05 Favored 'General case' 0 C--N 1.395 2.56 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -35.55 62.88 Favored 'General case' 0 C--N 1.39 2.357 0 C-N-CA 125.397 1.479 . . . . 0.0 113.165 -176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.57 -51.73 68.65 Favored 'General case' 0 N--CA 1.512 2.669 0 C-N-CA 125.047 1.339 . . . . 0.0 111.915 175.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.63 -41.6 92.46 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 125.647 1.579 . . . . 0.0 111.741 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.436 HD11 ' HB3' ' B' ' 119' ' ' ARG . 1.9 mp -58.33 -49.89 75.58 Favored 'General case' 0 C--N 1.395 2.586 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 176.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -61.99 -42.39 99.09 Favored 'General case' 0 N--CA 1.514 2.772 0 C-N-CA 125.745 1.618 . . . . 0.0 115.029 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -64.33 -48.74 74.43 Favored 'General case' 0 C--N 1.392 2.438 0 CA-C-N 112.071 -2.332 . . . . 0.0 110.525 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.55 -15.42 54.88 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.119 -1.855 . . . . 0.0 113.252 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -69.08 -42.5 76.1 Favored 'General case' 0 C--N 1.411 3.24 0 CA-C-N 119.618 1.099 . . . . 0.0 110.658 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -71.38 -22.77 61.84 Favored 'General case' 0 C--N 1.384 2.065 0 C-N-CA 124.911 1.284 . . . . 0.0 111.638 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -79.95 -43.39 22.17 Favored 'General case' 0 C--N 1.393 2.458 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.647 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -49.26 59.58 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 125.533 1.533 . . . . 0.0 112.835 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.78 -36.97 76.16 Favored 'General case' 0 C--N 1.388 2.246 0 C-N-CA 125.997 1.719 . . . . 0.0 111.407 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.26 -26.59 74.11 Favored Glycine 0 C--N 1.388 3.433 0 CA-C-N 119.398 0.999 . . . . 0.0 113.418 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -76.1 -29.4 57.89 Favored 'General case' 0 C--N 1.39 2.369 0 C-N-CA 125.174 1.389 . . . . 0.0 109.548 173.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.85 -35.96 92.68 Favored Glycine 1 C--N 1.406 4.468 0 CA-C-N 118.911 0.778 . . . . 0.0 114.126 173.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.6 m -59.91 -49.04 79.26 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.19 1.796 . . . . 0.0 113.054 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.22 -67.88 0.24 Allowed 'General case' 0 C--N 1.401 2.832 0 C-N-CA 127.748 2.419 . . . . 0.0 113.652 176.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.52 -14.88 61.3 Favored 'General case' 0 N--CA 1.515 2.784 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 75.79 51.59 7.0 Favored Glycine 0 C--N 1.366 2.2 0 N-CA-C 118.092 1.997 . . . . 0.0 118.092 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.97 133.43 51.81 Favored 'General case' 0 C--O 1.257 1.466 0 CA-C-N 120.085 1.942 . . . . 0.0 109.373 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.28 121.99 17.98 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.922 0.868 . . . . 0.0 110.023 174.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.44 ' O ' HG23 ' B' ' 158' ' ' THR 0.262 0.6 OUTLIER -57.32 -43.59 82.53 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.208 0 C-N-CA 127.532 2.333 . . . . 0.0 116.212 -176.115 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.96 -41.16 99.45 Favored 'General case' 0 N--CA 1.521 3.095 0 CA-C-N 119.243 0.929 . . . . 0.0 113.276 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.57 -30.25 64.25 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 124.833 1.253 . . . . 0.0 109.562 177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.96 -28.9 62.68 Favored 'General case' 0 C--N 1.372 1.553 0 O-C-N 125.02 1.45 . . . . 0.0 111.707 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.44 HG23 ' O ' ' B' ' 154' ' ' ILE . 44.8 p -69.09 -12.19 61.46 Favored 'General case' 0 C--N 1.408 3.143 0 CA-C-N 119.717 1.144 . . . . 0.0 112.99 175.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -108.11 -42.14 4.73 Favored 'General case' 0 N--CA 1.517 2.899 0 CA-C-N 112.161 -2.291 . . . . 0.0 110.545 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.41 -46.89 88.22 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 126.412 1.885 . . . . 0.0 109.83 173.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -72.96 -32.65 60.57 Favored Glycine 0 C--N 1.384 3.203 0 CA-C-O 116.445 -2.308 . . . . 0.0 114.774 173.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -46.22 -49.65 16.83 Favored 'General case' 0 N--CA 1.522 3.149 0 CA-C-N 119.537 1.668 . . . . 0.0 112.385 171.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -66.27 -36.44 82.99 Favored 'General case' 0 C--N 1.388 2.258 0 C-N-CA 125.635 1.574 . . . . 0.0 112.469 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.261 57.0 mt -64.89 -53.75 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.293 0 CA-C-O 116.294 -1.812 . . . . 0.0 110.648 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.33 -47.9 57.0 Favored 'Isoleucine or valine' 1 N--CA 1.556 4.865 0 CA-C-N 120.48 1.491 . . . . 0.0 111.96 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -56.32 -86.21 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.195 0 O-C-N 126.164 2.165 . . . . 0.0 109.357 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 5.8 mtm180 -43.58 -37.9 2.74 Favored 'General case' 0 N--CA 1.511 2.598 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 173.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.276 1.1 pp -73.48 -11.45 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.041 0 CA-C-N 122.578 2.445 . . . . 0.0 113.754 177.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.54 12.03 33.64 Favored 'General case' 0 C--N 1.395 2.572 0 CA-C-O 122.284 1.04 . . . . 0.0 110.784 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -123.72 -9.01 7.87 Favored 'General case' 0 N--CA 1.505 2.297 0 CA-C-N 112.863 -1.971 . . . . 0.0 107.958 177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -91.69 -68.93 0.76 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 109.934 -3.303 . . . . 0.0 110.059 178.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -130.16 132.86 46.24 Favored 'General case' 0 C--N 1.393 2.482 0 C-N-CA 127.837 2.455 . . . . 0.0 108.223 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 122.278 2.308 . . . . 0.0 112.166 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.612 0.72 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.7 159.31 19.05 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 124.467 1.107 . . . . 0.0 111.208 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 65.9 m -86.58 4.24 40.98 Favored 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.1 m-80 -83.74 -16.85 43.29 Favored 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 124.121 0.968 . . . . 0.0 110.492 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 m -88.39 -21.15 24.46 Favored 'General case' 0 N--CA 1.501 2.095 0 C-N-CA 125.99 1.716 . . . . 0.0 107.545 176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.8 t -86.15 -38.1 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.2 m -67.83 -35.18 78.14 Favored 'General case' 0 C--N 1.395 2.544 0 C-N-CA 124.459 1.103 . . . . 0.0 111.879 174.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -74.12 -15.55 61.04 Favored 'General case' 0 C--N 1.396 2.627 0 C-N-CA 124.595 1.158 . . . . 0.0 111.599 174.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -89.0 -41.59 12.26 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -65.82 -37.51 86.43 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 125.461 1.504 . . . . 0.0 111.328 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.61 -40.26 76.92 Favored 'Isoleucine or valine' 0 C--N 1.385 2.144 0 C-N-CA 125.026 1.33 . . . . 0.0 109.672 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.66 -30.21 70.88 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.19 0.905 . . . . 0.0 111.494 174.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 95.9 m -67.86 -39.3 83.8 Favored 'General case' 0 C--N 1.395 2.585 0 C-N-CA 123.69 0.796 . . . . 0.0 109.931 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.448 ' HA ' HG23 ' A' ' 58' ' ' THR . 59.7 t80 -70.87 -49.67 43.54 Favored 'General case' 0 C--N 1.386 2.188 0 C-N-CA 124.946 1.298 . . . . 0.0 110.413 175.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.11 -38.39 90.9 Favored 'General case' 0 C--N 1.384 2.096 0 CA-C-O 117.887 -1.054 . . . . 0.0 113.648 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.81 -27.7 66.09 Favored 'General case' 0 CA--C 1.583 2.217 0 CA-C-N 119.464 1.029 . . . . 0.0 111.853 171.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -79.66 -26.31 41.08 Favored 'General case' 0 C--N 1.389 2.323 0 CA-C-N 119.743 1.156 . . . . 0.0 109.368 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 81.2 t -71.35 -38.09 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -78.34 -29.33 47.51 Favored 'General case' 0 CA--C 1.585 2.312 0 C-N-CA 124.546 1.138 . . . . 0.0 112.983 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' ASP 0.285 0.0 OUTLIER -83.37 -13.28 55.29 Favored 'General case' 0 C--N 1.404 2.943 0 C-N-CA 123.791 0.837 . . . . 0.0 112.703 177.933 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -88.15 -24.05 23.45 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 128.693 2.797 . . . . 0.0 106.493 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -84.59 -47.27 10.72 Favored 'General case' 0 CA--C 1.583 2.233 0 C-N-CA 126.391 1.876 . . . . 0.0 110.363 174.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.42 89.5 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 124.658 1.183 . . . . 0.0 113.967 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -71.9 -6.9 45.21 Favored 'General case' 0 N--CA 1.526 3.345 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -103.85 -7.89 20.16 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 128.773 2.829 . . . . 0.0 110.365 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.265 14.0 mt-10 63.77 54.67 1.77 Allowed 'General case' 0 N--CA 1.524 3.253 0 C-N-CA 127.659 2.384 . . . . 0.0 113.177 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.96 126.73 53.4 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.505 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.541 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.19 -165.54 20.7 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 112.578 -2.101 . . . . 0.0 108.944 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.91 -171.24 1.87 Allowed 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 119.601 1.7 . . . . 0.0 109.049 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -35.91 37.4 Favored Pre-proline 0 CA--C 1.597 2.769 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -61.51 -19.16 63.5 Favored 'Trans proline' 1 C--N 1.462 6.542 0 CA-C-N 124.547 2.66 . . . . 0.0 116.407 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -68.58 -25.7 65.02 Favored 'General case' 0 C--N 1.4 2.795 0 C-N-CA 124.241 1.016 . . . . 0.0 112.957 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -80.84 -33.48 34.56 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 127.09 2.156 . . . . 0.0 109.471 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -50.71 72.38 Favored 'General case' 0 N--CA 1.514 2.726 0 C-N-CA 125.443 1.497 . . . . 0.0 111.212 173.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.94 -45.21 82.65 Favored 'General case' 0 C--N 1.398 2.688 0 C-N-CA 126.697 1.999 . . . . 0.0 112.55 177.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -44.64 73.48 Favored 'General case' 0 C--N 1.402 2.858 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 177.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -63.43 -43.56 97.1 Favored 'General case' 0 C--N 1.397 2.669 0 C-N-CA 126.556 1.942 . . . . 0.0 115.221 -176.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -64.09 -51.73 62.62 Favored 'General case' 0 C--N 1.396 2.61 0 O-C-N 126.165 2.165 . . . . 0.0 111.622 -175.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.7 -17.21 51.81 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 113.049 -1.887 . . . . 0.0 112.865 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.8 -42.65 81.24 Favored 'General case' 0 C--N 1.398 2.713 0 CA-C-N 118.53 0.605 . . . . 0.0 110.772 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -71.1 -24.5 62.31 Favored 'General case' 0 C--N 1.399 2.749 0 C-N-CA 125.734 1.613 . . . . 0.0 112.036 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -78.15 -43.55 28.48 Favored 'General case' 0 C--N 1.39 2.34 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.43 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -47.2 67.56 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.802 1.641 . . . . 0.0 112.752 177.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.21 -36.97 72.09 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 126.463 1.905 . . . . 0.0 112.111 178.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.65 -27.34 73.18 Favored Glycine 0 C--N 1.394 3.775 0 CA-C-N 119.867 1.212 . . . . 0.0 113.533 174.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -72.92 -28.37 62.42 Favored 'General case' 0 C--N 1.385 2.145 0 CA-C-N 113.177 -1.512 . . . . 0.0 109.219 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.18 -38.47 96.57 Favored Glycine 1 C--N 1.406 4.458 0 N-CA-C 115.203 0.841 . . . . 0.0 115.203 173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.9 m -59.9 -49.29 78.26 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 125.996 1.718 . . . . 0.0 113.555 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -60.32 3.76 Favored 'General case' 0 N--CA 1.516 2.856 0 C-N-CA 126.828 2.051 . . . . 0.0 114.846 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.256 15.9 mt -78.46 -12.24 60.0 Favored 'General case' 0 N--CA 1.513 2.707 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 74.18 44.77 27.87 Favored Glycine 0 C--N 1.365 2.149 0 N-CA-C 117.66 1.824 . . . . 0.0 117.66 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.39 134.07 54.63 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-N 119.836 1.818 . . . . 0.0 109.822 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 120.29 16.94 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.459 0.704 . . . . 0.0 109.326 175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.262 0.5 OUTLIER -52.76 -43.49 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.554 0 C-N-CA 127.218 2.207 . . . . 0.0 115.554 -176.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.91 -46.69 83.69 Favored 'General case' 0 N--CA 1.521 3.111 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.1 t -72.52 -36.07 68.24 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.602 1.161 . . . . 0.0 112.551 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.49 78.2 Favored 'General case' 0 C--N 1.383 2.054 0 O-C-N 124.356 1.035 . . . . 0.0 111.635 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.448 HG23 ' HA ' ' A' ' 14' ' ' PHE . 16.9 m -55.73 -53.01 61.83 Favored 'General case' 0 C--N 1.393 2.461 0 O-C-N 124.35 1.032 . . . . 0.0 111.162 175.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.41 -41.72 94.49 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 126.126 2.141 . . . . 0.0 113.092 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.41 -48.02 81.53 Favored 'General case' 0 C--N 1.38 1.927 0 C-N-CA 126.149 1.779 . . . . 0.0 112.034 174.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -75.04 -26.86 65.53 Favored Glycine 0 C--N 1.386 3.36 0 CA-C-O 117.339 -1.812 . . . . 0.0 114.976 174.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -49.04 -48.97 43.41 Favored 'General case' 0 N--CA 1.515 2.78 0 CA-C-N 118.378 1.089 . . . . 0.0 112.194 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -65.11 -36.48 84.43 Favored 'General case' 0 C--N 1.397 2.674 0 C-N-CA 126.058 1.743 . . . . 0.0 110.963 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.901 ' O ' HG12 ' A' ' 68' ' ' ILE 0.348 0.6 OUTLIER -74.12 -15.52 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.594 2.662 0 CA-C-N 113.188 -1.824 . . . . 0.0 112.183 178.744 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 75.3 t -92.01 -55.08 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.631 0 C-N-CA 124.923 1.289 . . . . 0.0 108.046 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -57.44 -73.32 0.07 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 126.014 2.072 . . . . 0.0 111.476 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -51.79 -37.63 52.3 Favored 'General case' 0 N--CA 1.517 2.888 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.901 HG12 ' O ' ' A' ' 64' ' ' ILE . 1.1 pt -70.3 -18.88 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.535 3.815 0 CA-C-N 122.227 2.285 . . . . 0.0 114.393 178.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -29.67 18.1 Favored 'General case' 0 C--N 1.381 1.94 0 O-C-N 123.616 0.572 . . . . 0.0 111.326 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.26 -7.83 58.58 Favored 'General case' 0 CA--C 1.599 2.843 0 CA-C-O 122.888 1.328 . . . . 0.0 110.861 173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -107.89 -41.49 4.96 Favored 'General case' 0 N--CA 1.513 2.698 0 CA-C-N 110.979 -2.828 . . . . 0.0 111.822 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -144.13 126.09 15.37 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.387 1.903 . . . . 0.0 107.037 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-N 122.212 2.278 . . . . 0.0 112.083 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.575 0.702 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.32 158.9 19.21 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.616 1.167 . . . . 0.0 111.17 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 64.3 m -86.38 3.99 41.26 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.541 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.1 m-80 -83.98 -16.14 45.14 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 124.197 0.999 . . . . 0.0 110.607 174.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.4 m -89.81 -21.23 22.7 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 126.009 1.723 . . . . 0.0 107.395 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 43.1 t -85.77 -37.96 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.1 m -68.09 -34.85 77.17 Favored 'General case' 0 C--N 1.394 2.52 0 C-N-CA 124.466 1.106 . . . . 0.0 111.887 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 1.2 m -75.76 -11.44 59.99 Favored 'General case' 0 C--N 1.397 2.653 0 C-N-CA 124.145 0.978 . . . . 0.0 111.763 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -92.65 -41.48 10.16 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -66.1 -37.26 85.32 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 125.314 1.446 . . . . 0.0 111.258 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.78 -40.38 76.68 Favored 'Isoleucine or valine' 0 C--N 1.386 2.19 0 C-N-CA 124.948 1.299 . . . . 0.0 109.587 174.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -30.19 70.89 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 119.28 0.946 . . . . 0.0 111.508 174.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.7 m -67.64 -39.5 84.62 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.875 0.87 . . . . 0.0 109.982 175.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . 0.453 ' HA ' HG23 ' B' ' 158' ' ' THR . 58.9 t80 -70.91 -49.84 41.45 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 125.065 1.346 . . . . 0.0 110.45 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.3 mp -63.82 -38.45 91.15 Favored 'General case' 0 C--N 1.383 2.052 0 C-N-CA 124.275 1.03 . . . . 0.0 113.773 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -69.13 -27.46 65.59 Favored 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 119.354 0.979 . . . . 0.0 111.745 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -79.54 -26.74 41.39 Favored 'General case' 0 C--N 1.388 2.251 0 CA-C-N 119.81 1.186 . . . . 0.0 109.366 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 79.8 t -71.16 -38.0 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.228 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -78.18 -29.2 48.38 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.632 1.173 . . . . 0.0 112.949 176.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 0.0 OUTLIER -85.66 -7.95 58.51 Favored 'General case' 0 C--N 1.407 3.09 0 CA-C-N 118.778 0.717 . . . . 0.0 112.924 178.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -92.39 -24.38 18.9 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 129.264 3.026 . . . . 0.0 106.215 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -84.54 -47.5 10.51 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 126.409 1.884 . . . . 0.0 110.355 174.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.38 89.52 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 124.684 1.194 . . . . 0.0 114.01 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.2 -5.74 37.89 Favored 'General case' 0 N--CA 1.526 3.365 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 178.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -104.94 -8.12 18.83 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 129.029 2.932 . . . . 0.0 110.531 176.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.26 13.9 mt-10 63.9 53.62 1.88 Allowed 'General case' 0 N--CA 1.523 3.193 0 C-N-CA 127.757 2.423 . . . . 0.0 113.11 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.01 126.75 53.09 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 112.738 -2.028 . . . . 0.0 110.422 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 99.55 -165.78 20.4 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 112.649 -2.068 . . . . 0.0 108.878 -174.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.09 -171.02 1.82 Allowed 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 119.622 1.711 . . . . 0.0 108.92 176.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.07 -35.89 36.63 Favored Pre-proline 0 CA--C 1.598 2.799 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -61.65 -18.76 62.02 Favored 'Trans proline' 1 C--N 1.463 6.591 0 CA-C-N 124.522 2.651 . . . . 0.0 116.408 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.88 -25.59 64.69 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.156 0.982 . . . . 0.0 112.914 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.98 -33.24 33.94 Favored 'General case' 0 C--N 1.383 2.064 0 C-N-CA 126.921 2.089 . . . . 0.0 109.456 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -50.78 71.97 Favored 'General case' 0 N--CA 1.514 2.727 0 C-N-CA 125.409 1.484 . . . . 0.0 111.13 173.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -65.76 -45.17 83.53 Favored 'General case' 0 C--N 1.399 2.739 0 C-N-CA 126.628 1.971 . . . . 0.0 112.453 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -44.68 73.14 Favored 'General case' 0 C--N 1.402 2.867 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 8.0 mtm180 -63.53 -43.68 96.44 Favored 'General case' 0 C--N 1.398 2.698 0 C-N-CA 126.529 1.932 . . . . 0.0 115.345 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.0 mtm180 -64.06 -51.78 62.48 Favored 'General case' 0 C--N 1.398 2.712 0 CA-C-N 112.548 -2.115 . . . . 0.0 111.555 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -80.98 -15.83 55.13 Favored 'General case' 0 C--N 1.376 1.759 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.861 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -68.92 -42.41 76.83 Favored 'General case' 0 C--N 1.399 2.748 0 CA-C-N 118.609 0.64 . . . . 0.0 110.633 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -71.15 -24.67 62.31 Favored 'General case' 0 C--N 1.399 2.747 0 C-N-CA 125.668 1.587 . . . . 0.0 112.01 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 2.0 t -78.01 -43.11 30.46 Favored 'General case' 0 C--N 1.39 2.339 0 CA-C-N 111.886 -2.416 . . . . 0.0 109.349 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -47.25 67.01 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 125.671 1.588 . . . . 0.0 112.616 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -71.3 -37.01 71.85 Favored 'General case' 0 C--N 1.386 2.172 0 C-N-CA 126.436 1.894 . . . . 0.0 112.166 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.34 -27.7 73.22 Favored Glycine 0 C--N 1.395 3.818 0 CA-C-N 119.758 1.163 . . . . 0.0 113.508 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -72.66 -28.14 62.54 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.193 -1.504 . . . . 0.0 109.181 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.32 -38.7 96.85 Favored Glycine 1 C--N 1.406 4.445 0 N-CA-C 115.267 0.867 . . . . 0.0 115.267 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 65.3 m -59.66 -49.38 77.95 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 126.008 1.723 . . . . 0.0 113.43 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.72 -68.96 0.13 Allowed 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 127.457 2.303 . . . . 0.0 113.887 176.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.251 15.6 mt -72.42 -13.3 61.42 Favored 'General case' 0 N--CA 1.514 2.772 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.74 46.86 16.5 Favored Glycine 0 C--N 1.367 2.287 0 N-CA-C 117.849 1.899 . . . . 0.0 117.849 173.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.95 134.3 53.53 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 119.642 1.721 . . . . 0.0 109.844 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.84 120.27 17.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.352 0.661 . . . . 0.0 109.293 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -53.03 -43.01 46.78 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.583 0 C-N-CA 127.159 2.184 . . . . 0.0 115.52 -176.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.12 -46.88 82.19 Favored 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.3 t -72.68 -35.98 67.8 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 124.572 1.149 . . . . 0.0 112.581 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.73 -34.25 77.76 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 124.38 1.05 . . . . 0.0 111.553 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.453 HG23 ' HA ' ' B' ' 114' ' ' PHE . 16.9 m -56.08 -52.9 62.63 Favored 'General case' 0 C--N 1.394 2.534 0 O-C-N 124.432 1.083 . . . . 0.0 111.176 176.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -60.56 -41.82 95.35 Favored 'General case' 0 N--CA 1.519 3.0 0 O-C-N 126.036 2.085 . . . . 0.0 113.129 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.88 82.35 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 126.049 1.739 . . . . 0.0 112.002 174.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.49 -27.79 64.82 Favored Glycine 0 C--N 1.387 3.37 0 CA-C-O 117.407 -1.774 . . . . 0.0 114.881 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.42 -49.13 36.34 Favored 'General case' 0 N--CA 1.513 2.719 0 CA-C-N 118.393 1.097 . . . . 0.0 112.108 171.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -65.02 -36.27 83.84 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 125.931 1.692 . . . . 0.0 110.986 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.881 ' O ' HG12 ' B' ' 168' ' ' ILE 0.303 0.6 OUTLIER -77.63 -4.05 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.601 2.919 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.898 179.159 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.82 -54.18 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.393 0 C-N-CA 125.673 1.589 . . . . 0.0 106.783 176.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -54.97 -82.57 0.01 OUTLIER 'General case' 0 C--N 1.373 1.591 0 O-C-N 126.139 2.149 . . . . 0.0 109.279 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -45.54 -38.9 6.84 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 118.043 2.609 . . . . 0.0 118.043 174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.881 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.1 pt -70.48 -13.34 17.03 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.008 0 CA-C-N 123.22 2.737 . . . . 0.0 114.745 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -28.57 14.64 Favored 'General case' 0 C--N 1.378 1.832 0 O-C-N 123.263 0.352 . . . . 0.0 111.383 -177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -81.01 -5.76 57.98 Favored 'General case' 0 N--CA 1.521 3.103 0 CA-C-O 123.651 1.691 . . . . 0.0 110.906 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -95.76 -66.87 0.88 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 109.854 -3.339 . . . . 0.0 111.427 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -129.38 128.34 42.86 Favored 'General case' 0 C--N 1.398 2.708 0 C-N-CA 126.972 2.109 . . . . 0.0 107.754 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.977 0 CA-C-N 122.433 2.378 . . . . 0.0 111.859 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.804 0.811 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.05 -80.15 0.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 124.795 1.238 . . . . 0.0 111.912 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.0 m -133.38 179.5 6.17 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.493 1.917 . . . . 0.0 111.194 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.474 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.3 m-20 -72.52 -11.86 60.84 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 125.87 1.668 . . . . 0.0 114.748 -176.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.46 -22.59 28.19 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 124.828 1.251 . . . . 0.0 108.156 177.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.2 t -88.89 -39.52 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.7 m -67.42 -34.67 77.71 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.071 0.948 . . . . 0.0 111.917 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.72 -16.43 60.15 Favored 'General case' 0 C--N 1.393 2.472 0 CA-C-N 119.567 1.076 . . . . 0.0 112.041 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -88.78 -44.98 10.13 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.439 176.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -64.47 -39.67 94.24 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 125.337 1.455 . . . . 0.0 111.621 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -71.7 -39.04 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 C-N-CA 124.77 1.228 . . . . 0.0 110.826 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.36 -26.69 66.6 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 119.185 0.902 . . . . 0.0 111.623 173.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 97.2 m -67.93 -39.91 83.44 Favored 'General case' 0 C--N 1.388 2.259 0 C-N-CA 123.885 0.874 . . . . 0.0 109.745 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -67.9 -50.25 57.3 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 124.938 1.295 . . . . 0.0 109.916 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.79 -35.5 80.06 Favored 'General case' 0 C--N 1.383 2.048 0 O-C-N 124.164 0.915 . . . . 0.0 112.767 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.403 ' HZ2' ' O ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -70.88 -25.74 62.94 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 172.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.55 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 32.6 t60 -84.02 -22.53 31.28 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 118.936 0.789 . . . . 0.0 109.074 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.2 t -73.5 -39.04 53.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 174.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -74.59 -29.59 61.37 Favored 'General case' 0 C--N 1.383 2.053 0 C-N-CA 124.022 0.929 . . . . 0.0 112.346 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -86.98 -14.33 42.0 Favored 'General case' 0 C--N 1.399 2.726 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.55 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 7.1 mtt180 -86.69 -20.43 27.76 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 128.752 2.821 . . . . 0.0 105.966 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -86.91 -46.57 9.77 Favored 'General case' 0 CA--C 1.583 2.218 0 C-N-CA 126.993 2.117 . . . . 0.0 109.797 172.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -45.32 86.91 Favored 'General case' 0 N--CA 1.509 2.489 0 C-N-CA 125.574 1.549 . . . . 0.0 114.823 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.46 -6.11 33.48 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.411 HE22 HG23 ' B' ' 168' ' ' ILE . 3.0 mt-30 -104.7 -9.56 18.08 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 128.712 2.805 . . . . 0.0 110.679 177.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.269 10.6 mt-10 64.21 55.75 1.43 Allowed 'General case' 0 N--CA 1.525 3.279 0 C-N-CA 127.709 2.404 . . . . 0.0 112.587 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.96 124.32 50.5 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 112.551 -2.113 . . . . 0.0 110.862 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 101.28 -167.73 19.44 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 112.849 -1.978 . . . . 0.0 109.545 -174.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.18 -171.15 1.84 Allowed 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 119.924 1.862 . . . . 0.0 109.233 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -37.36 48.5 Favored Pre-proline 0 CA--C 1.595 2.678 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.463 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 44.3 Cg_exo -61.16 -19.45 63.61 Favored 'Trans proline' 1 C--N 1.463 6.599 0 CA-C-N 124.153 2.519 . . . . 0.0 115.77 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.24 -34.32 78.07 Favored 'General case' 0 C--N 1.395 2.582 0 C-N-CA 124.406 1.082 . . . . 0.0 111.855 178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 36' ' ' LEU . 2.3 mm? -73.38 -32.75 64.65 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.872 2.069 . . . . 0.0 110.152 177.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.6 m-20 -60.21 -49.79 76.24 Favored 'General case' 0 N--CA 1.513 2.7 0 C-N-CA 125.343 1.457 . . . . 0.0 111.203 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.42 -44.62 86.81 Favored 'General case' 0 C--N 1.4 2.771 0 C-N-CA 126.468 1.907 . . . . 0.0 112.929 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 33' ' ' LEU . 29.2 mt -58.77 -43.6 90.43 Favored 'General case' 0 C--N 1.396 2.609 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -62.49 -42.24 99.36 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 125.828 1.651 . . . . 0.0 114.863 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.79 -49.91 71.04 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 112.201 -2.272 . . . . 0.0 111.437 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.16 -15.94 48.64 Favored 'General case' 0 C--N 1.377 1.771 0 CA-C-N 112.908 -1.951 . . . . 0.0 113.227 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -67.68 -42.08 82.66 Favored 'General case' 0 C--N 1.406 3.024 0 CA-C-N 119.168 0.895 . . . . 0.0 110.654 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -72.3 -23.1 61.13 Favored 'General case' 0 C--N 1.383 2.04 0 C-N-CA 125.585 1.554 . . . . 0.0 111.919 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -79.94 -43.7 21.65 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.805 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.94 -45.09 75.25 Favored 'General case' 0 C--N 1.393 2.48 0 C-N-CA 125.238 1.415 . . . . 0.0 112.712 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -71.39 -38.03 71.53 Favored 'General case' 0 C--N 1.386 2.177 0 C-N-CA 126.259 1.823 . . . . 0.0 112.072 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.88 -29.47 74.7 Favored Glycine 0 C--N 1.393 3.75 0 CA-C-N 119.9 1.227 . . . . 0.0 113.684 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -72.5 -28.84 63.13 Favored 'General case' 0 C--N 1.385 2.12 0 CA-C-N 113.476 -1.362 . . . . 0.0 109.021 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -37.59 94.96 Favored Glycine 1 C--N 1.406 4.466 0 CA-C-N 119.022 0.828 . . . . 0.0 114.895 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -59.41 -48.77 80.38 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.171 1.788 . . . . 0.0 113.157 178.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -60.51 3.42 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 126.805 2.042 . . . . 0.0 114.517 176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.266 5.8 mt -78.15 -12.33 59.99 Favored 'General case' 0 N--CA 1.512 2.65 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 177.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.13 46.39 27.93 Favored Glycine 0 C--N 1.366 2.214 0 N-CA-C 117.563 1.785 . . . . 0.0 117.563 173.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.65 136.23 54.37 Favored 'General case' 0 C--O 1.26 1.607 0 CA-C-N 119.521 1.661 . . . . 0.0 109.537 -177.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.79 120.33 13.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.19 0.519 . . . . 0.0 109.662 174.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.614 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.35 -46.27 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 126.566 1.946 . . . . 0.0 114.285 -178.307 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -61.36 -45.43 94.43 Favored 'General case' 0 N--CA 1.521 3.113 0 CA-C-N 119.228 0.922 . . . . 0.0 112.72 176.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.83 -32.43 72.13 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 123.403 0.681 . . . . 0.0 110.986 176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -32.16 65.94 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 124.524 1.14 . . . . 0.0 112.138 175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.3 p -64.47 -19.86 65.83 Favored 'General case' 0 N--CA 1.525 3.288 0 CA-C-O 122.766 1.27 . . . . 0.0 112.432 176.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.5 mtt180 -99.45 -43.02 6.7 Favored 'General case' 0 C--N 1.402 2.861 0 CA-C-N 110.905 -2.861 . . . . 0.0 111.077 -174.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.34 81.44 Favored 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 112.908 -1.951 . . . . 0.0 110.479 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.99 -26.13 69.67 Favored Glycine 0 C--N 1.385 3.276 0 CA-C-O 117.395 -1.781 . . . . 0.0 114.661 174.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -47.86 -47.24 31.78 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 118.303 1.051 . . . . 0.0 111.016 169.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 50.9 mt-30 -67.62 -35.73 79.49 Favored 'General case' 0 C--N 1.391 2.394 0 C-N-CA 125.433 1.493 . . . . 0.0 111.354 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.296 13.2 mt -72.87 -16.01 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.225 0 C-N-CA 125.147 1.379 . . . . 0.0 111.751 179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.5 t -91.61 -55.57 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.534 3.751 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 7.5 mt-10 -54.85 -58.6 6.93 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 112.345 -2.207 . . . . 0.0 110.81 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 71' ' ' GLU 0.265 95.7 mtt180 -68.83 -39.83 79.77 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 111.325 -2.67 . . . . 0.0 114.078 -179.182 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.458 HG23 HE22 ' B' ' 125' ' ' GLN 0.276 0.0 OUTLIER -72.8 -16.95 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.614 3.44 0 CA-C-N 121.93 2.15 . . . . 0.0 115.418 178.101 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 37.3 mt -91.84 -31.24 15.79 Favored 'General case' 0 N--CA 1.519 3.004 0 CA-C-N 119.008 0.822 . . . . 0.0 112.711 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 5.1 ptpt -76.29 -17.63 59.36 Favored 'General case' 0 N--CA 1.525 3.287 0 CA-C-O 123.328 1.537 . . . . 0.0 111.164 173.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.0 tt0 -78.72 -42.38 28.42 Favored 'General case' 0 C--N 1.368 1.407 0 CA-C-N 110.148 -3.205 . . . . 0.0 114.8 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 64.47 87.0 0.12 Allowed 'General case' 1 C--N 1.428 4.003 0 N-CA-C 105.36 -2.089 . . . . 0.0 105.36 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 118.43 -0.795 . . . . 0.0 111.95 -169.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.729 0.776 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -120.15 -80.69 0.62 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.888 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.1 m -132.87 179.51 6.13 Favored 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 126.577 1.951 . . . . 0.0 111.117 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.494 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.4 m-20 -73.24 -9.66 58.94 Favored 'General case' 0 N--CA 1.505 2.318 0 C-N-CA 125.524 1.53 . . . . 0.0 114.877 -176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.36 -20.98 25.95 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.9 1.28 . . . . 0.0 108.143 177.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 3.3 t -91.22 -38.98 11.33 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.296 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 74.0 m -67.78 -34.48 76.87 Favored 'General case' 0 C--N 1.387 2.205 0 C-N-CA 123.999 0.92 . . . . 0.0 111.752 174.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.11 -13.13 59.99 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.722 1.146 . . . . 0.0 112.255 175.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -91.45 -44.8 8.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.149 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -64.63 -39.54 93.89 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 43.2 t -71.83 -39.13 67.46 Favored 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 124.699 1.199 . . . . 0.0 110.799 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -26.61 66.7 Favored 'General case' 0 C--N 1.389 2.313 0 CA-C-N 119.203 0.91 . . . . 0.0 111.713 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.5 m -67.92 -40.03 83.43 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 123.964 0.906 . . . . 0.0 109.78 174.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -67.84 -50.32 57.26 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 124.915 1.286 . . . . 0.0 109.944 175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -35.63 80.18 Favored 'General case' 0 C--N 1.384 2.09 0 O-C-N 124.05 0.844 . . . . 0.0 112.787 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -70.81 -25.73 62.99 Favored 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 172.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.575 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 32.7 t60 -83.9 -22.85 31.46 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 118.988 0.813 . . . . 0.0 109.079 178.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 86.7 t -73.13 -39.03 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 174.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -74.7 -29.0 61.04 Favored 'General case' 0 C--N 1.384 2.094 0 C-N-CA 123.935 0.894 . . . . 0.0 112.325 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 28.8 tttt -89.44 -9.67 49.29 Favored 'General case' 0 C--N 1.402 2.89 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 6.8 mtt180 -90.49 -19.44 23.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 129.119 2.968 . . . . 0.0 105.804 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -88.53 -46.22 9.27 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 126.911 2.084 . . . . 0.0 109.641 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.19 86.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 125.456 1.502 . . . . 0.0 114.663 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.3 -4.36 25.55 Favored 'General case' 0 N--CA 1.513 2.692 0 N-CA-C 113.955 1.095 . . . . 0.0 113.955 179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . 0.458 HE22 HG23 ' A' ' 68' ' ' ILE . 3.1 mt-30 -105.87 -9.63 17.07 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 128.757 2.823 . . . . 0.0 110.61 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.274 10.9 mt-10 64.15 55.65 1.47 Allowed 'General case' 0 N--CA 1.525 3.278 0 C-N-CA 127.735 2.414 . . . . 0.0 112.667 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -108.93 124.27 50.41 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 112.538 -2.119 . . . . 0.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 101.24 -167.73 19.48 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-N 112.765 -2.016 . . . . 0.0 109.509 -174.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.13 -171.22 1.86 Allowed 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.868 1.834 . . . . 0.0 109.127 178.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.84 -37.46 49.77 Favored Pre-proline 0 CA--C 1.594 2.641 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 42.1 Cg_exo -61.37 -18.79 61.16 Favored 'Trans proline' 1 C--N 1.464 6.65 0 CA-C-N 124.101 2.501 . . . . 0.0 115.843 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -65.68 -34.26 77.8 Favored 'General case' 0 C--N 1.395 2.558 0 C-N-CA 124.372 1.069 . . . . 0.0 111.844 177.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' B' ' 136' ' ' LEU . 2.3 mm? -73.42 -32.82 64.63 Favored 'General case' 0 C--N 1.389 2.31 0 C-N-CA 126.886 2.074 . . . . 0.0 110.144 177.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.7 m-20 -60.11 -49.86 75.99 Favored 'General case' 0 N--CA 1.514 2.731 0 C-N-CA 125.287 1.435 . . . . 0.0 111.302 172.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -65.3 -44.64 87.24 Favored 'General case' 0 C--N 1.398 2.717 0 C-N-CA 126.466 1.906 . . . . 0.0 113.017 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 133' ' ' LEU . 28.8 mt -58.78 -43.74 90.51 Favored 'General case' 0 C--N 1.394 2.54 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -62.38 -42.23 99.25 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 125.907 1.683 . . . . 0.0 114.903 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -63.78 -50.0 70.74 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.11 -2.314 . . . . 0.0 111.359 -175.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.97 -13.91 52.16 Favored 'General case' 0 C--N 1.378 1.808 0 CA-C-N 113.011 -1.904 . . . . 0.0 113.3 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -68.85 -42.13 77.52 Favored 'General case' 0 C--N 1.405 3.007 0 CA-C-N 119.1 0.863 . . . . 0.0 110.574 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -72.21 -23.15 61.2 Favored 'General case' 0 C--N 1.383 2.033 0 C-N-CA 125.61 1.564 . . . . 0.0 111.911 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.2 t -79.86 -43.73 21.78 Favored 'General case' 0 C--N 1.392 2.453 0 CA-C-N 112.248 -2.251 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.06 -45.04 74.96 Favored 'General case' 0 C--N 1.394 2.543 0 C-N-CA 125.232 1.413 . . . . 0.0 112.656 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -71.36 -38.11 71.6 Favored 'General case' 0 C--N 1.385 2.143 0 C-N-CA 126.311 1.845 . . . . 0.0 112.057 177.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.79 -29.47 74.74 Favored Glycine 0 C--N 1.394 3.761 0 CA-C-N 119.941 1.246 . . . . 0.0 113.703 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -72.4 -28.92 63.29 Favored 'General case' 0 C--N 1.385 2.116 0 CA-C-N 113.435 -1.382 . . . . 0.0 108.922 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.79 -37.69 95.06 Favored Glycine 1 C--N 1.407 4.476 0 CA-C-N 119.045 0.839 . . . . 0.0 114.997 174.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 68.4 m -59.06 -48.8 80.28 Favored 'General case' 0 N--CA 1.502 2.148 0 C-N-CA 126.266 1.827 . . . . 0.0 113.057 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.28 -69.28 0.12 Allowed 'General case' 0 N--CA 1.515 2.815 0 C-N-CA 127.511 2.325 . . . . 0.0 113.651 175.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.258 5.9 mt -72.13 -13.68 61.63 Favored 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.57 48.68 17.01 Favored Glycine 0 C--N 1.368 2.311 0 N-CA-C 117.587 1.795 . . . . 0.0 117.587 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.15 136.32 53.49 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 119.408 1.604 . . . . 0.0 109.506 -177.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.89 120.35 14.04 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.247 0.546 . . . . 0.0 109.599 174.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.619 ' O ' HG23 ' B' ' 158' ' ' THR 0.254 0.8 OUTLIER -53.16 -46.44 55.66 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 C-N-CA 126.572 1.949 . . . . 0.0 114.284 -178.286 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -61.15 -45.9 92.75 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.197 0.908 . . . . 0.0 112.67 176.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.31 -32.25 72.26 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.345 0.658 . . . . 0.0 110.989 176.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.05 -31.31 64.33 Favored 'General case' 0 C--N 1.375 1.711 0 O-C-N 124.52 1.137 . . . . 0.0 112.009 175.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.619 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.5 p -66.38 -13.1 60.15 Favored 'General case' 0 N--CA 1.524 3.268 0 CA-C-O 122.568 1.175 . . . . 0.0 112.924 176.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -109.16 -41.21 4.74 Favored 'General case' 0 C--N 1.393 2.467 0 CA-C-N 111.792 -2.458 . . . . 0.0 110.282 -172.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.24 -48.39 80.15 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 126.037 1.735 . . . . 0.0 110.127 172.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.06 -26.61 68.28 Favored Glycine 0 C--N 1.387 3.405 0 CA-C-O 117.561 -1.689 . . . . 0.0 114.665 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -47.46 -46.8 27.18 Favored 'General case' 0 N--CA 1.512 2.648 0 CA-C-N 118.223 1.012 . . . . 0.0 110.893 169.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 50.9 mt-30 -67.99 -35.56 78.53 Favored 'General case' 0 C--N 1.39 2.34 0 C-N-CA 125.335 1.454 . . . . 0.0 111.249 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . 0.252 9.8 mt -76.43 -3.63 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.615 3.445 0 C-N-CA 124.583 1.153 . . . . 0.0 112.306 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 99.9 t -103.78 -54.79 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.439 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' B' ' 170' ' ' LYS . 7.6 mt-10 -55.4 -57.56 11.35 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 125.98 2.05 . . . . 0.0 110.304 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' B' ' 163' ' ' GLN 0.263 95.6 mtt180 -70.09 -39.81 75.34 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 111.13 -2.759 . . . . 0.0 113.966 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.411 HG23 HE22 ' A' ' 25' ' ' GLN 0.264 0.0 OUTLIER -73.95 -10.95 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.619 3.607 0 CA-C-N 122.313 2.324 . . . . 0.0 115.78 178.263 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.48 -29.85 12.87 Favored 'General case' 0 N--CA 1.523 3.213 0 CA-C-N 119.383 0.992 . . . . 0.0 112.444 -177.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' B' ' 166' ' ' GLU . 5.1 ptpt -76.42 -16.85 59.6 Favored 'General case' 0 N--CA 1.524 3.266 0 CA-C-O 123.535 1.636 . . . . 0.0 110.83 173.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -74.57 -57.12 4.13 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 109.62 -3.446 . . . . 0.0 113.623 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 73.82 88.78 0.09 Allowed 'General case' 0 C--N 1.421 3.701 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.594 -169.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.52 0.676 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.38 110.07 21.12 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 124.37 1.068 . . . . 0.0 111.535 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.4 m -101.41 -44.63 5.57 Favored 'General case' 0 N--CA 1.502 2.129 0 C-N-CA 127.083 2.153 . . . . 0.0 113.955 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.631 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 14.6 m-80 -85.4 -16.06 41.05 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-N 120.442 1.474 . . . . 0.0 114.057 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.41 -19.94 25.9 Favored 'General case' 0 N--CA 1.504 2.238 0 C-N-CA 124.343 1.057 . . . . 0.0 109.064 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.0 t -88.58 -36.9 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.535 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.628 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.6 m -67.71 -32.51 73.2 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 124.012 0.925 . . . . 0.0 111.93 174.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.16 -16.7 60.5 Favored 'General case' 0 C--N 1.393 2.497 0 C-N-CA 123.989 0.916 . . . . 0.0 112.146 174.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -88.39 -43.76 11.26 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-O 118.429 -0.795 . . . . 0.0 109.239 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -65.01 -40.79 95.42 Favored 'General case' 0 N--CA 1.515 2.792 0 C-N-CA 125.24 1.416 . . . . 0.0 112.176 -178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.4 t -71.9 -39.75 67.6 Favored 'Isoleucine or valine' 0 C--N 1.379 1.858 0 C-N-CA 124.769 1.228 . . . . 0.0 110.644 177.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.26 -28.76 68.31 Favored 'General case' 0 C--N 1.388 2.256 0 CA-C-N 119.271 0.941 . . . . 0.0 111.922 174.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.408 ' O ' HG22 ' A' ' 58' ' ' THR . 80.1 m -67.6 -39.42 84.79 Favored 'General case' 0 C--N 1.394 2.501 0 C-N-CA 124.274 1.03 . . . . 0.0 110.803 174.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -67.89 -49.07 64.09 Favored 'General case' 0 C--N 1.384 2.098 0 C-N-CA 124.699 1.199 . . . . 0.0 109.572 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -63.19 -36.25 83.0 Favored 'General case' 0 C--N 1.383 2.06 0 C-N-CA 124.103 0.961 . . . . 0.0 112.545 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.764 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 82.1 t90 -63.71 -37.81 88.75 Favored 'General case' 0 CA--C 1.57 1.728 0 CA-C-O 117.623 -1.18 . . . . 0.0 112.923 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 31.8 t60 -75.94 -21.49 56.99 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 120.147 1.34 . . . . 0.0 109.603 -178.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 76.1 t -74.18 -38.91 49.19 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.125 0 O-C-N 125.695 1.872 . . . . 0.0 107.014 174.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.84 -28.42 36.14 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 123.273 0.629 . . . . 0.0 112.523 178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -85.1 -8.98 58.41 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 123.975 0.91 . . . . 0.0 111.756 176.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 1.6 tpt180 -87.98 -23.9 23.7 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 128.521 2.729 . . . . 0.0 106.399 172.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.67 -47.23 9.34 Favored 'General case' 0 CA--C 1.575 1.921 0 C-N-CA 125.94 1.696 . . . . 0.0 111.21 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.23 87.46 Favored 'General case' 0 CA--C 1.583 2.224 0 C-N-CA 124.895 1.278 . . . . 0.0 114.087 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -72.86 -7.01 48.83 Favored 'General case' 0 N--CA 1.52 3.068 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.58 -10.59 16.77 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 128.855 2.862 . . . . 0.0 110.521 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 11.8 mt-10 65.06 41.33 4.66 Favored 'General case' 0 N--CA 1.521 3.096 0 C-N-CA 128.124 2.569 . . . . 0.0 112.641 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.3 127.89 43.66 Favored 'General case' 0 C--N 1.366 1.293 0 CA-C-N 112.762 -2.017 . . . . 0.0 109.727 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 96.35 -167.91 25.18 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 106.894 -2.482 . . . . 0.0 106.894 -172.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.03 -177.43 3.74 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 121.539 2.669 . . . . 0.0 109.273 177.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.95 -36.56 46.5 Favored Pre-proline 0 CA--C 1.593 2.602 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 48.5 Cg_exo -60.78 -15.79 40.0 Favored 'Trans proline' 1 C--N 1.459 6.395 0 CA-C-N 123.93 2.439 . . . . 0.0 116.333 179.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.15 -30.11 70.54 Favored 'General case' 0 C--N 1.398 2.692 0 C-N-CA 123.346 0.658 . . . . 0.0 111.425 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.52 -36.0 57.97 Favored 'General case' 0 C--N 1.386 2.176 0 C-N-CA 127.013 2.125 . . . . 0.0 109.241 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 2.3 m-20 -59.08 -50.29 74.62 Favored 'General case' 0 N--CA 1.526 3.373 0 C-N-CA 125.587 1.555 . . . . 0.0 111.892 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.05 -46.81 85.74 Favored 'General case' 0 C--N 1.397 2.663 0 C-N-CA 127.21 2.204 . . . . 0.0 112.307 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.555 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -55.65 -47.66 76.28 Favored 'General case' 0 C--N 1.391 2.391 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 178.049 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.75 -41.36 95.27 Favored 'General case' 0 C--N 1.402 2.879 0 C-N-CA 126.708 2.003 . . . . 0.0 114.705 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -63.47 -49.2 74.55 Favored 'General case' 0 C--N 1.392 2.445 0 CA-C-N 111.798 -2.456 . . . . 0.0 110.477 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.78 -15.78 50.42 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.113 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.764 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 71.3 mt-30 -67.79 -41.57 82.99 Favored 'General case' 0 C--N 1.411 3.259 0 CA-C-N 119.655 1.116 . . . . 0.0 110.859 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -74.07 -24.5 59.51 Favored 'General case' 0 C--N 1.388 2.252 0 C-N-CA 125.046 1.338 . . . . 0.0 112.694 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.89 -44.53 22.57 Favored 'General case' 0 C--N 1.39 2.364 0 CA-C-N 112.612 -2.085 . . . . 0.0 110.638 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -42.14 82.34 Favored 'General case' 0 C--N 1.383 2.058 0 C-N-CA 124.872 1.269 . . . . 0.0 113.153 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -71.85 -38.36 70.1 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 127.184 2.193 . . . . 0.0 111.449 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.39 -29.59 74.35 Favored Glycine 0 C--N 1.393 3.711 0 CA-C-N 120.139 1.336 . . . . 0.0 113.324 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -72.75 -29.75 63.58 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 125.178 1.391 . . . . 0.0 108.925 172.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.1 -37.54 95.09 Favored Glycine 1 C--N 1.404 4.309 0 N-CA-C 115.264 0.865 . . . . 0.0 115.264 173.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.5 m -59.53 -49.0 79.46 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 126.197 1.799 . . . . 0.0 113.309 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.34 -60.22 3.83 Favored 'General case' 0 N--CA 1.516 2.869 0 C-N-CA 126.866 2.066 . . . . 0.0 114.397 177.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.263 21.6 mt -78.7 -13.82 59.62 Favored 'General case' 0 N--CA 1.51 2.535 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.57 47.09 36.16 Favored Glycine 0 C--N 1.366 2.205 0 N-CA-C 117.637 1.815 . . . . 0.0 117.637 173.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.28 134.94 54.67 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.11 1.455 . . . . 0.0 109.101 -177.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 119.73 11.98 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.3 0.572 . . . . 0.0 110.715 175.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.527 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.63 -45.1 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 126.737 2.015 . . . . 0.0 113.923 -178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -61.7 -42.86 99.5 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -74.19 -28.22 61.18 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 123.27 0.628 . . . . 0.0 110.373 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.03 -31.97 64.79 Favored 'General case' 0 C--N 1.382 2.01 0 O-C-N 124.264 0.978 . . . . 0.0 112.122 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.527 HG23 ' O ' ' A' ' 54' ' ' ILE . 49.7 p -64.49 -19.04 65.34 Favored 'General case' 0 C--N 1.41 3.203 0 CA-C-O 122.44 1.114 . . . . 0.0 112.452 175.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -99.05 -43.08 6.81 Favored 'General case' 0 C--N 1.401 2.807 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.656 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.21 82.56 Favored 'General case' 0 C--N 1.383 2.065 0 C-N-CA 127.107 2.163 . . . . 0.0 110.534 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.21 -30.01 63.53 Favored Glycine 0 C--N 1.384 3.205 0 CA-C-O 117.243 -1.865 . . . . 0.0 114.411 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -48.06 -49.3 31.97 Favored 'General case' 0 N--CA 1.519 2.998 0 CA-C-N 118.758 1.279 . . . . 0.0 112.363 170.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.49 -36.93 79.62 Favored 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.735 1.614 . . . . 0.0 112.072 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.66 -54.76 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 CA-C-O 116.664 -1.636 . . . . 0.0 110.631 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 63.3 t -54.65 -48.97 71.07 Favored 'Isoleucine or valine' 1 N--CA 1.543 4.212 0 C-N-CA 125.812 1.645 . . . . 0.0 112.497 176.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -56.01 -74.3 0.05 OUTLIER 'General case' 0 CA--C 1.573 1.841 0 O-C-N 126.224 2.202 . . . . 0.0 109.407 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -52.26 -38.24 57.63 Favored 'General case' 0 N--CA 1.508 2.44 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.293 1.2 pp -68.42 -17.63 22.4 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.257 0 CA-C-N 123.494 2.861 . . . . 0.0 115.051 179.509 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.45 -22.02 21.61 Favored 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.7 mtmt -88.39 -18.35 28.55 Favored 'General case' 0 CA--C 1.601 2.91 0 CA-C-N 114.555 -1.202 . . . . 0.0 112.613 175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -87.8 -49.96 6.77 Favored 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 117.83 2.529 . . . . 0.0 117.83 -177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -148.73 -3.74 0.45 Allowed 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 117.282 -1.342 . . . . 0.0 114.481 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.377 1.787 0 CA-C-N 122.617 2.462 . . . . 0.0 112.163 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.504 0.669 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.18 109.34 20.27 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 122.368 1.08 . . . . 0.0 111.392 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 35.6 m -100.77 -44.11 5.9 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 126.962 2.105 . . . . 0.0 113.715 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.654 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 14.6 m-80 -85.79 -16.01 40.19 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 120.32 1.418 . . . . 0.0 114.015 -179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.32 -17.84 28.12 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 124.214 1.006 . . . . 0.0 109.043 177.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 t -91.15 -36.01 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.472 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -68.4 -31.49 70.88 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 123.878 0.871 . . . . 0.0 111.842 174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.07 -13.99 59.88 Favored 'General case' 0 C--N 1.395 2.568 0 CA-C-N 119.101 0.864 . . . . 0.0 112.27 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -90.52 -43.67 10.08 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.362 -0.828 . . . . 0.0 109.005 175.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -64.96 -40.85 95.62 Favored 'General case' 0 N--CA 1.512 2.644 0 C-N-CA 125.14 1.376 . . . . 0.0 112.126 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.06 -39.69 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 C-N-CA 124.67 1.188 . . . . 0.0 110.727 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -28.58 68.16 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 119.343 0.974 . . . . 0.0 111.86 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . 0.403 ' O ' HG22 ' B' ' 158' ' ' THR . 76.3 m -67.82 -39.38 83.94 Favored 'General case' 0 C--N 1.393 2.479 0 C-N-CA 124.213 1.005 . . . . 0.0 110.823 174.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -68.01 -48.91 64.42 Favored 'General case' 0 C--N 1.385 2.12 0 C-N-CA 124.664 1.186 . . . . 0.0 109.544 174.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.14 -36.17 82.73 Favored 'General case' 0 C--N 1.381 1.978 0 O-C-N 124.307 1.004 . . . . 0.0 112.546 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.75 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 82.3 t90 -63.75 -37.78 88.66 Favored 'General case' 0 CA--C 1.57 1.712 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.95 169.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.661 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 31.9 t60 -76.03 -21.89 56.34 Favored 'General case' 0 C--N 1.392 2.419 0 CA-C-N 120.235 1.38 . . . . 0.0 109.662 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.7 -38.79 52.08 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.029 0 O-C-N 125.73 1.894 . . . . 0.0 106.882 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -80.85 -28.2 36.17 Favored 'General case' 0 C--N 1.385 2.152 0 C-N-CA 123.167 0.587 . . . . 0.0 112.37 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 1.2 tmtt? -88.58 -0.79 57.61 Favored 'General case' 0 C--N 1.408 3.119 0 CA-C-O 121.311 0.577 . . . . 0.0 111.971 176.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 1.6 tpt180 -94.66 -23.24 17.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 129.404 3.082 . . . . 0.0 105.989 172.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -87.76 -46.82 9.13 Favored 'General case' 0 CA--C 1.572 1.809 0 C-N-CA 125.751 1.62 . . . . 0.0 110.867 175.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.31 85.08 Favored 'General case' 0 CA--C 1.581 2.155 0 C-N-CA 124.803 1.241 . . . . 0.0 114.027 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.5 OUTLIER -73.48 -5.55 40.73 Favored 'General case' 0 N--CA 1.522 3.135 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -106.79 -10.21 16.15 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 128.911 2.885 . . . . 0.0 110.488 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.264 12.0 mt-10 64.85 41.19 5.06 Favored 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 128.161 2.585 . . . . 0.0 112.716 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.9 128.04 43.47 Favored 'General case' 0 C--N 1.366 1.298 0 CA-C-N 112.801 -1.999 . . . . 0.0 109.688 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 96.3 -167.49 24.96 Favored Glycine 0 C--N 1.348 1.228 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.22 -177.6 3.77 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 121.358 2.579 . . . . 0.0 109.228 177.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.11 -36.58 47.03 Favored Pre-proline 0 CA--C 1.592 2.566 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . 0.401 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 40.1 Cg_exo -62.19 -12.33 26.32 Favored 'Trans proline' 1 C--N 1.46 6.398 0 CA-C-N 124.041 2.479 . . . . 0.0 116.439 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -68.09 -29.95 69.01 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 123.273 0.629 . . . . 0.0 111.213 177.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.67 -35.82 57.69 Favored 'General case' 0 C--N 1.386 2.161 0 C-N-CA 126.975 2.11 . . . . 0.0 109.328 175.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 2.4 m-20 -59.07 -50.49 73.88 Favored 'General case' 0 N--CA 1.527 3.403 0 C-N-CA 125.589 1.556 . . . . 0.0 111.853 172.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -63.03 -46.71 86.3 Favored 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.13 2.172 . . . . 0.0 112.352 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.568 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.7 OUTLIER -55.62 -47.85 75.89 Favored 'General case' 0 C--N 1.39 2.369 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 178.066 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -60.52 -41.37 94.25 Favored 'General case' 0 C--N 1.401 2.844 0 C-N-CA 126.806 2.042 . . . . 0.0 114.741 -176.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -63.51 -49.28 74.14 Favored 'General case' 0 C--N 1.391 2.412 0 CA-C-N 111.748 -2.478 . . . . 0.0 110.466 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -13.69 53.6 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 112.951 -1.932 . . . . 0.0 113.025 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.75 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 71.0 mt-30 -69.11 -41.43 77.42 Favored 'General case' 0 C--N 1.41 3.23 0 CA-C-N 119.72 1.146 . . . . 0.0 110.724 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -74.02 -24.66 59.59 Favored 'General case' 0 C--N 1.387 2.237 0 C-N-CA 125.034 1.333 . . . . 0.0 112.765 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.83 -44.54 22.77 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.543 -2.117 . . . . 0.0 110.719 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.65 -42.17 82.67 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 124.926 1.29 . . . . 0.0 113.079 177.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -72.05 -38.25 69.52 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.17 2.188 . . . . 0.0 111.394 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.78 74.69 Favored Glycine 0 C--N 1.393 3.742 0 CA-C-N 120.158 1.345 . . . . 0.0 113.369 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.64 -29.69 63.67 Favored 'General case' 0 C--N 1.386 2.19 0 CA-C-N 113.454 -1.373 . . . . 0.0 108.873 172.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.16 -37.58 95.13 Favored Glycine 1 C--N 1.404 4.324 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.0 m -59.17 -49.1 79.14 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.308 1.843 . . . . 0.0 113.216 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -69.18 0.12 Allowed 'General case' 0 N--CA 1.515 2.816 0 C-N-CA 127.515 2.326 . . . . 0.0 113.585 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.255 21.6 mt -72.41 -15.47 61.84 Favored 'General case' 0 N--CA 1.51 2.563 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.28 49.42 20.73 Favored Glycine 0 C--N 1.367 2.281 0 N-CA-C 117.688 1.835 . . . . 0.0 117.688 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 134.99 53.62 Favored 'General case' 0 C--O 1.258 1.549 0 CA-C-N 119.063 1.432 . . . . 0.0 109.182 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.31 119.52 11.69 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.382 0.61 . . . . 0.0 110.611 175.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.522 ' O ' HG23 ' B' ' 158' ' ' THR . 0.5 OUTLIER -55.18 -45.42 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.701 2.0 . . . . 0.0 113.892 -178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -61.44 -43.46 98.83 Favored 'General case' 0 N--CA 1.514 2.745 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.41 -28.02 61.76 Favored 'General case' 0 CA--C 1.571 1.786 0 C-N-CA 123.195 0.598 . . . . 0.0 110.328 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.66 -31.24 63.38 Favored 'General case' 0 C--N 1.382 1.991 0 O-C-N 124.325 1.016 . . . . 0.0 112.119 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.522 HG23 ' O ' ' B' ' 154' ' ' ILE . 49.7 p -66.4 -12.43 56.97 Favored 'General case' 0 C--N 1.41 3.233 0 CA-C-O 122.332 1.063 . . . . 0.0 113.029 175.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -108.33 -41.08 4.97 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 111.556 -2.565 . . . . 0.0 110.137 -173.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.75 -48.31 81.29 Favored 'General case' 0 C--N 1.383 2.041 0 C-N-CA 126.662 1.985 . . . . 0.0 110.277 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.14 63.44 Favored Glycine 0 C--N 1.387 3.385 0 CA-C-O 117.167 -1.907 . . . . 0.0 114.561 173.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -47.88 -49.41 29.72 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-N 118.745 1.272 . . . . 0.0 112.496 170.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -68.56 -36.06 78.25 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 125.891 1.676 . . . . 0.0 112.063 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -59.26 4.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.283 0 O-C-N 125.499 1.749 . . . . 0.0 110.234 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.1 t -50.09 -49.15 22.75 Favored 'Isoleucine or valine' 1 N--CA 1.547 4.411 0 C-N-CA 126.12 1.768 . . . . 0.0 112.338 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -53.34 -84.77 0.01 OUTLIER 'General case' 0 C--O 1.269 2.12 0 O-C-N 126.555 2.41 . . . . 0.0 108.31 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -44.01 -37.54 3.03 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' B' ' 171' ' ' GLU . 1.2 pp -72.96 -10.8 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.628 0 CA-C-N 123.45 2.841 . . . . 0.0 114.156 178.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.17 11.89 34.51 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-O 121.815 0.817 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -126.1 -18.4 5.02 Favored 'General case' 0 N--CA 1.514 2.756 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.8 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' B' ' 168' ' ' ILE . 5.0 mt-10 -81.67 -75.91 0.27 Allowed 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 128.987 2.915 . . . . 0.0 114.597 -178.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -126.3 -3.79 6.79 Favored 'General case' 0 C--N 1.378 1.814 0 N-CA-C 116.266 1.95 . . . . 0.0 116.266 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.376 1.748 0 CA-C-N 123.085 2.675 . . . . 0.0 112.338 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.403 0.62 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.78 112.61 24.41 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 122.358 1.075 . . . . 0.0 112.112 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -101.62 -44.92 5.42 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.977 2.111 . . . . 0.0 114.474 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -85.33 -14.73 45.58 Favored 'General case' 0 N--CA 1.513 2.694 0 CA-C-N 121.064 1.756 . . . . 0.0 114.513 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 m -91.73 -24.56 19.42 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 124.822 1.249 . . . . 0.0 109.596 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 56.0 t -87.17 -37.69 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.2 m -68.21 -31.64 71.3 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 123.682 0.793 . . . . 0.0 111.222 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.2 m -74.59 -17.6 60.69 Favored 'General case' 0 C--N 1.395 2.56 0 C-N-CA 124.223 1.009 . . . . 0.0 111.626 174.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -89.17 -44.27 10.43 Favored 'General case' 0 C--N 1.378 1.812 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -64.9 -39.58 93.75 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 125.607 1.563 . . . . 0.0 112.041 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -70.06 -38.04 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 C-N-CA 125.104 1.361 . . . . 0.0 110.185 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.62 -27.79 65.37 Favored 'General case' 0 CA--C 1.577 2.019 0 CA-C-N 118.725 0.693 . . . . 0.0 112.37 174.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' THR . 98.1 m -68.7 -41.36 79.25 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.259 1.023 . . . . 0.0 111.725 175.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.56 -43.84 95.89 Favored 'General case' 0 C--N 1.39 2.331 0 N-CA-C 106.919 -1.512 . . . . 0.0 106.919 172.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -38.6 91.62 Favored 'General case' 0 C--N 1.372 1.575 0 O-C-N 124.779 1.299 . . . . 0.0 114.02 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -63.13 -25.06 68.18 Favored 'General case' 0 CA--C 1.575 1.94 0 CA-C-N 120.042 1.292 . . . . 0.0 111.756 172.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 63.0 t60 -83.29 -24.76 32.07 Favored 'General case' 0 CA--C 1.583 2.247 0 CA-C-N 119.782 1.174 . . . . 0.0 109.654 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.1 t -74.46 -43.26 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 125.131 1.373 . . . . 0.0 109.195 177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.48 -28.51 56.51 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 124.037 0.935 . . . . 0.0 112.022 177.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . 0.312 0.0 OUTLIER -82.38 -11.84 58.3 Favored 'General case' 0 C--N 1.391 2.395 0 C-N-CA 123.284 0.634 . . . . 0.0 112.678 175.125 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -86.17 -24.83 25.99 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 127.564 2.346 . . . . 0.0 107.487 175.17 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -83.76 -45.39 13.4 Favored 'General case' 0 CA--C 1.577 2.009 0 C-N-CA 126.137 1.775 . . . . 0.0 111.206 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.61 -43.16 85.54 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.55 -7.47 50.29 Favored 'General case' 0 N--CA 1.513 2.719 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -105.32 -8.43 18.24 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 128.427 2.691 . . . . 0.0 110.475 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.335 12.6 mt-10 66.91 45.02 1.91 Allowed 'General case' 0 N--CA 1.516 2.831 0 C-N-CA 127.999 2.52 . . . . 0.0 114.467 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -107.39 -8.12 16.41 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.316 -2.22 . . . . 0.0 108.222 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -108.39 134.4 12.21 Favored Glycine 0 C--N 1.356 1.67 0 CA-C-N 110.832 -2.894 . . . . 0.0 108.989 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.0 -153.39 0.53 Allowed 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 119.453 1.627 . . . . 0.0 110.077 -174.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.66 -50.27 86.6 Favored Pre-proline 0 CA--C 1.594 2.649 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.069 176.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -62.62 -37.96 54.06 Favored 'Trans proline' 1 C--N 1.449 5.819 0 C-N-CA 123.587 2.858 . . . . 0.0 116.286 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.35 -40.95 81.35 Favored 'General case' 0 C--N 1.396 2.624 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -33.21 58.44 Favored 'General case' 0 C--N 1.387 2.203 0 C-N-CA 126.802 2.041 . . . . 0.0 112.305 -178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.96 -50.37 74.34 Favored 'General case' 0 N--CA 1.515 2.779 0 C-N-CA 125.644 1.577 . . . . 0.0 111.36 173.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -65.24 -43.69 90.6 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.885 177.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.12 -44.53 92.0 Favored 'General case' 0 C--N 1.394 2.525 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 176.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.5 mtm180 -61.78 -54.73 38.38 Favored 'General case' 0 C--N 1.403 2.896 0 C-N-CA 125.323 1.449 . . . . 0.0 114.645 -177.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -58.69 -44.36 90.25 Favored 'General case' 0 C--N 1.409 3.182 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.33 -17.18 55.07 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.739 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -68.84 -42.59 76.94 Favored 'General case' 0 C--N 1.401 2.82 0 CA-C-N 118.95 0.795 . . . . 0.0 110.215 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -71.55 -20.62 62.0 Favored 'General case' 0 C--N 1.397 2.636 0 C-N-CA 125.049 1.339 . . . . 0.0 111.841 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -42.62 18.08 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.319 -2.219 . . . . 0.0 109.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -48.55 66.02 Favored 'General case' 0 C--N 1.398 2.686 0 C-N-CA 125.534 1.534 . . . . 0.0 112.544 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.55 -37.45 74.02 Favored 'General case' 0 C--N 1.381 1.944 0 C-N-CA 126.191 1.797 . . . . 0.0 111.585 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 -28.51 73.08 Favored Glycine 0 C--N 1.388 3.442 0 CA-C-N 119.353 0.979 . . . . 0.0 113.756 174.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -73.26 -28.6 62.22 Favored 'General case' 0 C--N 1.389 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 108.771 173.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.07 -36.84 93.76 Favored Glycine 1 C--N 1.405 4.37 0 CA-C-O 119.07 -0.85 . . . . 0.0 114.877 173.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 m -59.31 -49.15 78.93 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.656 1.583 . . . . 0.0 112.905 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -61.39 2.56 Favored 'General case' 0 N--CA 1.513 2.681 0 C-N-CA 126.957 2.103 . . . . 0.0 115.251 177.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.252 22.8 mt -78.42 -14.1 59.53 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 76.56 47.29 10.4 Favored Glycine 0 C--N 1.357 1.748 0 N-CA-C 118.397 2.119 . . . . 0.0 118.397 172.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.81 131.97 54.0 Favored 'General case' 0 C--O 1.257 1.484 0 CA-C-N 120.374 2.087 . . . . 0.0 109.12 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.1 121.22 15.68 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.742 0.782 . . . . 0.0 109.645 174.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -57.26 -44.31 83.59 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.21 0 C-N-CA 127.291 2.236 . . . . 0.0 116.457 -175.768 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.27 -41.38 98.42 Favored 'General case' 0 N--CA 1.519 3.009 0 CA-C-N 119.954 1.252 . . . . 0.0 113.179 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -29.75 62.34 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 124.641 1.176 . . . . 0.0 109.433 177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.94 -28.53 62.49 Favored 'General case' 0 C--N 1.373 1.629 0 O-C-N 124.95 1.406 . . . . 0.0 111.467 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 13' ' ' CYS . 43.6 p -65.91 -18.87 65.63 Favored 'General case' 0 C--N 1.413 3.352 0 CA-C-O 122.218 1.009 . . . . 0.0 111.814 174.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -99.8 -43.55 6.39 Favored 'General case' 0 C--N 1.401 2.835 0 CA-C-N 111.472 -2.604 . . . . 0.0 111.489 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.16 82.31 Favored 'General case' 0 C--N 1.378 1.822 0 C-N-CA 126.916 2.087 . . . . 0.0 110.541 174.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.92 -26.7 66.2 Favored Glycine 0 C--N 1.387 3.38 0 CA-C-O 117.224 -1.876 . . . . 0.0 114.437 173.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.72 -48.0 40.77 Favored 'General case' 0 N--CA 1.513 2.697 0 CA-C-N 118.632 1.216 . . . . 0.0 112.252 170.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -67.26 -35.42 79.49 Favored 'General case' 0 C--N 1.387 2.223 0 C-N-CA 125.302 1.441 . . . . 0.0 111.976 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . 0.279 39.8 mt -67.63 -50.72 58.38 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.202 0 O-C-N 125.312 1.633 . . . . 0.0 110.676 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.2 t -59.08 -50.61 79.13 Favored 'Isoleucine or valine' 1 N--CA 1.545 4.281 0 CA-C-N 120.659 1.572 . . . . 0.0 112.601 176.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -56.72 -70.95 0.1 Allowed 'General case' 0 C--N 1.375 1.701 0 O-C-N 125.802 1.939 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -53.33 -37.57 62.43 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 117.159 2.281 . . . . 0.0 117.159 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . 0.369 1.1 pp -69.23 -17.21 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.537 3.878 0 CA-C-N 123.211 2.732 . . . . 0.0 115.249 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.27 -28.65 17.64 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-N 117.972 0.351 . . . . 0.0 110.383 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -80.05 -9.06 59.67 Favored 'General case' 0 N--CA 1.527 3.397 0 CA-C-O 123.354 1.549 . . . . 0.0 111.12 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.83 12.08 24.86 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 110.336 -3.12 . . . . 0.0 113.275 179.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -99.51 -28.15 13.38 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -171.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.383 2.056 0 C-N-CA 124.491 1.117 . . . . 0.0 112.239 -176.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 121.462 0.648 . . . . 0.0 111.682 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.79 112.4 24.06 Favored 'General case' 0 C--N 1.369 1.433 0 CA-C-O 122.321 1.057 . . . . 0.0 111.996 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 20.0 m -101.47 -44.54 5.58 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 126.818 2.047 . . . . 0.0 114.19 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -85.99 -12.21 50.94 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-N 121.025 1.739 . . . . 0.0 114.676 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -95.7 -22.47 17.52 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 124.717 1.207 . . . . 0.0 109.289 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 52.2 t -88.58 -37.61 10.51 Favored 'Isoleucine or valine' 0 C--N 1.369 1.418 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 63.2 m -69.26 -29.87 67.88 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.14 173.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 27.7 m -75.84 -15.51 60.22 Favored 'General case' 0 C--N 1.397 2.67 0 C-N-CA 123.813 0.845 . . . . 0.0 111.859 173.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -91.41 -43.91 9.46 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.66 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.7 -39.85 94.36 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.482 1.513 . . . . 0.0 111.843 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 42.7 t -70.31 -37.81 72.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 C-N-CA 125.05 1.34 . . . . 0.0 110.11 175.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -27.62 65.2 Favored 'General case' 0 CA--C 1.579 2.062 0 CA-C-N 118.918 0.781 . . . . 0.0 112.324 174.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . 0.459 ' O ' HG22 ' B' ' 158' ' ' THR . 99.3 m -68.76 -41.7 78.5 Favored 'General case' 0 C--N 1.397 2.652 0 C-N-CA 124.202 1.001 . . . . 0.0 111.796 175.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -63.61 -43.68 96.17 Favored 'General case' 0 C--N 1.389 2.305 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 172.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -39.05 93.26 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 124.793 1.308 . . . . 0.0 114.022 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 41.9 t90 -63.02 -24.81 68.09 Favored 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 119.975 1.262 . . . . 0.0 111.774 172.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' B' ' 121' ' ' ARG . 63.5 t60 -83.42 -25.08 31.59 Favored 'General case' 0 CA--C 1.583 2.214 0 CA-C-N 119.962 1.255 . . . . 0.0 109.668 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 69.3 t -74.36 -42.86 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 C-N-CA 125.125 1.37 . . . . 0.0 109.04 177.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.54 -28.27 56.25 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.785 0.834 . . . . 0.0 111.943 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . 0.266 0.0 OUTLIER -84.98 -5.64 59.35 Favored 'General case' 0 C--N 1.395 2.558 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 175.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' B' ' 117' ' ' HIS . 0.2 OUTLIER -91.08 -24.73 19.92 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 128.136 2.574 . . . . 0.0 107.116 174.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -83.78 -45.2 13.59 Favored 'General case' 0 CA--C 1.576 1.96 0 C-N-CA 126.012 1.725 . . . . 0.0 110.899 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.99 83.42 Favored 'General case' 0 N--CA 1.503 2.184 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.99 -7.26 50.38 Favored 'General case' 0 N--CA 1.512 2.659 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.29 -8.04 18.52 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 128.451 2.701 . . . . 0.0 110.465 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.331 12.7 mt-10 66.47 44.94 2.23 Favored 'General case' 0 N--CA 1.516 2.832 0 C-N-CA 127.912 2.485 . . . . 0.0 114.416 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.5 mt -107.52 -7.38 16.56 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 112.327 -2.215 . . . . 0.0 108.053 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -108.97 134.25 12.14 Favored Glycine 0 C--N 1.358 1.777 0 CA-C-N 110.836 -2.893 . . . . 0.0 108.923 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.15 -153.71 0.55 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 119.209 1.505 . . . . 0.0 110.188 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 85.49 Favored Pre-proline 0 CA--C 1.592 2.596 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.073 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.78 -37.57 54.87 Favored 'Trans proline' 1 C--N 1.449 5.858 0 C-N-CA 123.718 2.945 . . . . 0.0 116.192 174.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -40.77 80.0 Favored 'General case' 0 C--N 1.395 2.579 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.68 -33.02 58.27 Favored 'General case' 0 C--N 1.386 2.186 0 C-N-CA 126.773 2.029 . . . . 0.0 112.343 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.13 -50.5 73.8 Favored 'General case' 0 N--CA 1.514 2.735 0 C-N-CA 125.745 1.618 . . . . 0.0 111.34 173.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.0 mtt180 -65.17 -43.74 90.75 Favored 'General case' 0 C--N 1.389 2.315 0 C-N-CA 126.091 1.756 . . . . 0.0 111.847 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 1.5 mt -58.98 -44.61 91.59 Favored 'General case' 0 C--N 1.394 2.51 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 176.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -61.2 -55.39 32.7 Favored 'General case' 0 C--N 1.402 2.857 0 C-N-CA 125.538 1.535 . . . . 0.0 114.826 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -58.31 -44.65 88.67 Favored 'General case' 0 C--N 1.41 3.206 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -16.61 55.52 Favored 'General case' 0 C--N 1.392 2.413 0 CA-C-N 114.251 -1.34 . . . . 0.0 112.735 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.89 -42.88 76.31 Favored 'General case' 0 C--N 1.402 2.851 0 CA-C-N 118.835 0.743 . . . . 0.0 110.092 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -71.14 -21.26 62.21 Favored 'General case' 0 C--N 1.396 2.597 0 C-N-CA 125.283 1.433 . . . . 0.0 111.893 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.38 -42.76 18.23 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 112.161 -2.29 . . . . 0.0 109.37 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.51 -48.53 66.81 Favored 'General case' 0 C--N 1.397 2.658 0 C-N-CA 125.577 1.551 . . . . 0.0 112.583 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -70.65 -37.37 73.71 Favored 'General case' 0 C--N 1.38 1.928 0 C-N-CA 126.144 1.778 . . . . 0.0 111.541 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.97 -28.21 73.23 Favored Glycine 0 C--N 1.387 3.391 0 CA-C-N 119.34 0.973 . . . . 0.0 113.911 174.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -73.52 -28.56 61.96 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 124.946 1.298 . . . . 0.0 108.692 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.22 -36.82 93.7 Favored Glycine 1 C--N 1.403 4.281 0 CA-C-O 119.108 -0.829 . . . . 0.0 114.869 173.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.1 m -58.76 -49.22 78.45 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.692 1.597 . . . . 0.0 112.771 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.5 -71.08 0.08 Allowed 'General case' 0 N--CA 1.512 2.664 0 C-N-CA 127.824 2.45 . . . . 0.0 114.339 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 22.9 mt -71.85 -15.76 62.14 Favored 'General case' 0 N--CA 1.51 2.534 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 76.08 52.49 6.23 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 118.29 2.076 . . . . 0.0 118.29 172.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.76 132.01 52.39 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 120.142 1.971 . . . . 0.0 109.009 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.21 120.8 14.96 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.675 0.75 . . . . 0.0 109.703 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.271 0.5 OUTLIER -56.21 -45.05 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.301 0 C-N-CA 127.357 2.263 . . . . 0.0 116.51 -175.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.03 -42.07 98.77 Favored 'General case' 0 N--CA 1.522 3.128 0 CA-C-N 119.781 1.173 . . . . 0.0 113.152 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.23 -30.51 64.97 Favored 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 124.66 1.184 . . . . 0.0 109.518 177.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.18 -28.01 61.97 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 124.747 1.279 . . . . 0.0 111.549 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.459 HG22 ' O ' ' B' ' 113' ' ' CYS . 43.4 p -67.78 -11.97 59.61 Favored 'General case' 0 C--N 1.413 3.334 0 CA-C-N 119.409 1.004 . . . . 0.0 112.074 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -109.44 -41.42 4.61 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.178 -2.283 . . . . 0.0 110.601 -172.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.94 77.99 Favored 'General case' 0 C--N 1.377 1.8 0 C-N-CA 126.237 1.815 . . . . 0.0 110.131 173.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.91 -27.42 66.78 Favored Glycine 0 C--N 1.389 3.475 0 CA-C-O 117.122 -1.932 . . . . 0.0 114.47 173.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -47.33 -46.42 25.38 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 118.914 1.357 . . . . 0.0 111.974 170.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -68.6 -34.71 76.24 Favored 'General case' 0 C--N 1.385 2.137 0 C-N-CA 125.239 1.416 . . . . 0.0 111.896 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.521 ' O ' HG12 ' B' ' 168' ' ' ILE . 15.4 mt -76.75 -12.05 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.182 0 C-N-CA 124.671 1.189 . . . . 0.0 113.046 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.96 -51.28 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.532 3.671 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -54.33 -79.0 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.523 0 CA-C-N 111.653 -2.522 . . . . 0.0 108.567 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -47.56 -37.99 13.39 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 114.981 -2.438 . . . . 0.0 117.395 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.521 HG12 ' O ' ' B' ' 164' ' ' ILE 0.334 1.1 pp -72.35 -9.33 12.81 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.021 0 CA-C-N 124.182 3.174 . . . . 0.0 115.648 178.951 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.1 -26.7 14.5 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 118.522 0.601 . . . . 0.0 109.991 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.56 -8.16 59.68 Favored 'General case' 0 N--CA 1.523 3.206 0 CA-C-O 123.328 1.537 . . . . 0.0 110.67 174.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -93.71 12.22 26.33 Favored 'General case' 0 N--CA 1.503 2.215 0 CA-C-N 110.468 -3.06 . . . . 0.0 113.238 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -99.49 -28.25 13.33 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -171.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.385 2.143 0 C-N-CA 124.678 1.191 . . . . 0.0 112.415 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.5 2.035 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -101.64 108.05 19.48 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 122.584 1.183 . . . . 0.0 112.214 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -100.21 -47.27 5.01 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 112.693 -2.049 . . . . 0.0 113.672 177.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.567 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 9.6 m-80 -85.46 -18.68 32.88 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 120.434 1.47 . . . . 0.0 114.274 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -87.51 -26.75 23.03 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 123.743 0.817 . . . . 0.0 110.262 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 76.9 t -83.92 -29.96 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.662 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.0 m -67.62 -32.9 73.94 Favored 'General case' 0 C--N 1.398 2.712 0 C-N-CA 123.902 0.881 . . . . 0.0 111.223 173.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.6 m -71.73 -18.62 62.13 Favored 'General case' 0 C--N 1.405 2.981 0 C-N-CA 124.868 1.267 . . . . 0.0 110.904 173.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -89.58 -43.46 10.77 Favored 'General case' 0 CA--C 1.575 1.905 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.929 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -64.68 -42.06 95.61 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 125.311 1.444 . . . . 0.0 112.977 -178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.0 t -71.71 -38.76 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 C-N-CA 124.51 1.124 . . . . 0.0 110.255 176.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.31 -30.46 71.51 Favored 'General case' 0 C--N 1.39 2.355 0 CA-C-N 119.164 0.893 . . . . 0.0 112.181 173.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.42 ' O ' HG22 ' A' ' 58' ' ' THR . 86.4 m -66.55 -40.15 88.9 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 124.426 1.09 . . . . 0.0 111.243 175.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 18' ' ' VAL . 50.6 t80 -66.1 -50.0 65.6 Favored 'General case' 0 C--N 1.386 2.186 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.342 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -62.48 -37.4 85.8 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 124.611 1.195 . . . . 0.0 112.967 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.756 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 81.4 t90 -63.83 -35.07 79.41 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 117.823 -1.084 . . . . 0.0 112.521 170.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -76.16 -21.13 56.91 Favored 'General case' 0 C--N 1.392 2.454 0 CA-C-N 120.124 1.329 . . . . 0.0 109.068 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 14' ' ' PHE . 21.2 t -76.64 -33.87 22.87 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.156 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -83.31 -28.17 29.26 Favored 'General case' 0 C--N 1.389 2.319 0 C-N-CA 123.066 0.547 . . . . 0.0 111.728 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 4.5 tttt -86.17 -10.54 54.55 Favored 'General case' 0 C--N 1.403 2.93 0 C-N-CA 123.891 0.876 . . . . 0.0 112.302 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.63 25.19 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 127.719 2.408 . . . . 0.0 106.079 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -84.81 -48.83 8.98 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 126.013 1.725 . . . . 0.0 110.505 175.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.28 87.01 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 125.084 1.353 . . . . 0.0 114.437 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -72.29 -6.39 42.77 Favored 'General case' 0 N--CA 1.522 3.154 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 179.086 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.81 -8.52 19.72 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 128.784 2.834 . . . . 0.0 109.916 176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.266 10.3 mt-10 62.8 43.56 7.01 Favored 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 127.65 2.38 . . . . 0.0 112.781 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' B' ' 168' ' ' ILE . 0.9 OUTLIER -93.15 122.38 35.47 Favored 'General case' 0 C--O 1.255 1.345 0 CA-C-N 112.348 -2.206 . . . . 0.0 109.188 178.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.584 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 103.56 -167.95 16.99 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -174.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.06 -171.16 1.9 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 119.175 1.488 . . . . 0.0 108.261 176.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.16 -38.29 66.74 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.415 2.005 . . . . 0.0 116.415 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 34' ' ' ASP . 32.3 Cg_exo -62.57 -17.88 60.68 Favored 'Trans proline' 1 C--N 1.461 6.47 0 CA-C-N 124.019 2.471 . . . . 0.0 117.019 -178.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.06 -26.73 65.11 Favored 'General case' 0 C--N 1.394 2.532 0 C-N-CA 123.289 0.635 . . . . 0.0 112.561 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.9 -33.4 45.61 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 126.974 2.11 . . . . 0.0 109.18 175.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' PRO . 1.1 m-20 -61.19 -51.31 69.57 Favored 'General case' 0 N--CA 1.517 2.88 0 C-N-CA 125.806 1.642 . . . . 0.0 111.566 172.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -63.84 -45.78 87.98 Favored 'General case' 0 C--N 1.402 2.849 0 C-N-CA 127.202 2.201 . . . . 0.0 112.422 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -56.29 -47.25 79.02 Favored 'General case' 0 C--N 1.39 2.329 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 177.034 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.3 mtt180 -60.14 -40.51 90.04 Favored 'General case' 0 C--N 1.4 2.79 0 C-N-CA 126.313 1.845 . . . . 0.0 114.79 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mtp180 -64.27 -50.1 69.27 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 111.73 -2.486 . . . . 0.0 110.751 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.24 -16.58 45.88 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 113.343 -1.753 . . . . 0.0 113.738 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.756 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 72.2 mt-30 -67.09 -41.04 86.98 Favored 'General case' 0 C--N 1.406 3.042 0 CA-C-N 119.464 1.029 . . . . 0.0 110.219 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.24 -24.32 59.28 Favored 'General case' 0 C--N 1.389 2.295 0 C-N-CA 125.203 1.401 . . . . 0.0 112.772 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.3 t -78.37 -43.63 27.1 Favored 'General case' 0 C--N 1.39 2.338 0 CA-C-N 112.648 -2.069 . . . . 0.0 110.438 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.34 -43.9 76.49 Favored 'General case' 0 C--N 1.384 2.067 0 C-N-CA 124.993 1.317 . . . . 0.0 112.656 177.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.37 -38.02 71.59 Favored 'General case' 0 C--N 1.385 2.147 0 C-N-CA 126.793 2.037 . . . . 0.0 111.736 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.36 -27.85 73.56 Favored Glycine 0 C--N 1.391 3.617 0 CA-C-N 120.234 1.379 . . . . 0.0 113.796 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -73.51 -26.67 60.99 Favored 'General case' 0 C--N 1.383 2.05 0 C-N-CA 125.301 1.44 . . . . 0.0 108.395 173.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.52 -37.48 93.74 Favored Glycine 1 C--N 1.401 4.176 0 N-CA-C 115.182 0.833 . . . . 0.0 115.182 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.3 -48.18 82.59 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 125.832 1.653 . . . . 0.0 113.181 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -58.79 -56.23 24.95 Favored 'General case' 0 N--CA 1.51 2.55 0 C-N-CA 126.409 1.884 . . . . 0.0 114.61 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.276 3.1 mm? -80.63 -14.0 58.55 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 177.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.08 45.25 32.63 Favored Glycine 0 C--N 1.356 1.662 0 N-CA-C 117.46 1.744 . . . . 0.0 117.46 173.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.29 132.44 54.8 Favored 'General case' 0 C--O 1.258 1.527 0 CA-C-N 119.189 1.495 . . . . 0.0 108.595 -177.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.68 120.64 13.32 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.128 0.571 . . . . 0.0 109.685 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.55 ' O ' HG23 ' A' ' 58' ' ' THR 0.264 0.9 OUTLIER -53.96 -47.85 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 126.599 1.959 . . . . 0.0 114.571 -178.404 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -61.65 -44.13 97.54 Favored 'General case' 0 N--CA 1.523 3.198 0 CA-C-N 119.611 1.096 . . . . 0.0 112.804 176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t -69.93 -31.65 69.52 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.878 176.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.93 -33.07 67.96 Favored 'General case' 0 C--N 1.379 1.861 0 O-C-N 124.528 1.143 . . . . 0.0 111.929 175.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 54' ' ' ILE . 70.2 p -64.26 -19.34 65.32 Favored 'General case' 0 N--CA 1.524 3.25 0 CA-C-O 122.751 1.262 . . . . 0.0 112.595 176.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -99.34 -42.39 7.01 Favored 'General case' 0 C--N 1.402 2.888 0 CA-C-N 110.941 -2.845 . . . . 0.0 110.884 -174.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.19 -50.34 73.53 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.785 2.034 . . . . 0.0 110.471 173.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.01 -29.46 68.98 Favored Glycine 0 C--N 1.389 3.512 0 CA-C-O 117.751 -1.583 . . . . 0.0 114.398 175.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -48.66 -46.31 39.98 Favored 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 117.773 0.787 . . . . 0.0 111.296 169.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -69.6 -36.39 76.17 Favored 'General case' 0 C--N 1.394 2.526 0 C-N-CA 124.687 1.195 . . . . 0.0 111.788 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.678 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.309 14.1 mt -71.92 -14.07 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.24 0 C-N-CA 126.2 1.8 . . . . 0.0 111.877 179.425 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -91.08 -41.45 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.601 0 C-N-CA 124.627 1.171 . . . . 0.0 108.05 177.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -62.05 -45.74 92.2 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 111.913 -2.403 . . . . 0.0 108.711 176.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -73.75 -45.82 49.58 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 111.337 -2.665 . . . . 0.0 111.285 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.678 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.4 OUTLIER -47.23 -36.66 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.253 0 CA-C-N 123.986 3.085 . . . . 0.0 117.999 174.389 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -21.2 17.68 Favored 'General case' 0 C--N 1.39 2.343 0 CA-C-N 117.963 0.347 . . . . 0.0 111.129 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -90.59 -19.74 23.37 Favored 'General case' 0 CA--C 1.591 2.526 0 CA-C-O 121.988 0.899 . . . . 0.0 113.207 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -86.8 13.68 8.44 Favored 'General case' 0 N--CA 1.524 3.256 0 C-N-CA 127.825 2.45 . . . . 0.0 114.504 -178.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -101.39 -13.92 17.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -173.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.378 1.808 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.003 -178.565 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.7 mtt . . . . . 0 N--CA 1.499 1.985 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -100.96 107.55 19.06 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-O 122.651 1.215 . . . . 0.0 112.071 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 58.4 m -99.75 -46.91 5.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.504 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.584 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 9.4 m-80 -85.86 -18.49 32.7 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 120.356 1.435 . . . . 0.0 114.192 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 1.1 m -88.08 -26.5 22.49 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 123.766 0.826 . . . . 0.0 110.309 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 78.7 t -83.96 -29.89 7.5 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.632 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -67.47 -32.84 73.94 Favored 'General case' 0 C--N 1.397 2.638 0 C-N-CA 123.833 0.853 . . . . 0.0 111.205 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 6.2 m -72.32 -16.79 61.89 Favored 'General case' 0 C--N 1.405 2.992 0 C-N-CA 124.759 1.224 . . . . 0.0 111.171 173.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.58 -43.07 9.86 Favored 'General case' 0 CA--C 1.572 1.822 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.744 176.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.82 -41.96 95.35 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 125.223 1.409 . . . . 0.0 112.837 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 51.8 t -71.88 -38.72 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 124.435 1.094 . . . . 0.0 110.308 176.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.22 -30.58 71.63 Favored 'General case' 0 C--N 1.392 2.437 0 CA-C-N 119.172 0.896 . . . . 0.0 112.128 173.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . 0.412 ' O ' HG22 ' B' ' 158' ' ' THR . 87.0 m -66.56 -40.17 88.89 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 124.327 1.051 . . . . 0.0 111.221 175.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . 0.509 ' O ' HG23 ' B' ' 118' ' ' VAL . 50.6 t80 -65.93 -50.16 65.41 Favored 'General case' 0 C--N 1.386 2.165 0 C-N-CA 124.396 1.079 . . . . 0.0 109.326 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.39 -37.47 85.9 Favored 'General case' 0 C--N 1.383 2.064 0 O-C-N 124.552 1.157 . . . . 0.0 112.97 -178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.754 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 81.5 t90 -63.91 -35.06 79.42 Favored 'General case' 0 CA--C 1.575 1.937 0 CA-C-O 117.803 -1.094 . . . . 0.0 112.558 170.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -76.06 -21.57 56.62 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 120.16 1.345 . . . . 0.0 109.145 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 114' ' ' PHE . 21.4 t -76.09 -34.06 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.133 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -83.2 -27.7 29.81 Favored 'General case' 0 C--N 1.39 2.343 0 C-N-CA 122.933 0.493 . . . . 0.0 111.615 176.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 4.9 tttt -89.64 -2.52 58.33 Favored 'General case' 0 C--N 1.41 3.201 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -23.3 18.63 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 128.598 2.759 . . . . 0.0 105.582 171.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.47 -48.86 8.57 Favored 'General case' 0 CA--C 1.582 2.193 0 C-N-CA 125.905 1.682 . . . . 0.0 110.376 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.92 -45.31 86.42 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 125.088 1.355 . . . . 0.0 114.329 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -73.28 -4.32 32.44 Favored 'General case' 0 N--CA 1.521 3.109 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.36 -8.57 18.11 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 128.912 2.885 . . . . 0.0 109.98 176.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.265 10.3 mt-10 62.81 43.34 7.16 Favored 'General case' 0 N--CA 1.517 2.887 0 C-N-CA 127.612 2.365 . . . . 0.0 112.825 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.98 122.62 35.53 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-N 112.378 -2.192 . . . . 0.0 109.167 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 103.32 -167.41 16.77 Favored Glycine 0 C--N 1.345 1.032 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -174.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.42 -171.04 1.87 Allowed 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 119.175 1.487 . . . . 0.0 108.347 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.44 68.19 Favored Pre-proline 0 CA--C 1.595 2.7 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . 0.417 ' O ' ' HB2' ' B' ' 134' ' ' ASP . 32.0 Cg_exo -63.1 -16.51 54.88 Favored 'Trans proline' 1 C--N 1.461 6.474 0 CA-C-N 124.105 2.502 . . . . 0.0 117.068 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -69.96 -26.69 64.22 Favored 'General case' 0 C--N 1.394 2.539 0 C-N-CA 123.268 0.627 . . . . 0.0 112.397 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.93 -33.2 45.64 Favored 'General case' 0 N--CA 1.503 2.19 0 C-N-CA 126.936 2.094 . . . . 0.0 109.177 175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 131' ' ' PRO . 1.1 m-20 -61.39 -51.25 69.53 Favored 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 125.779 1.632 . . . . 0.0 111.572 172.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -63.95 -45.77 87.7 Favored 'General case' 0 C--N 1.401 2.82 0 C-N-CA 127.164 2.186 . . . . 0.0 112.39 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.609 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -56.24 -47.32 78.72 Favored 'General case' 0 C--N 1.389 2.303 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 15.6 mtt180 -59.96 -40.61 89.63 Favored 'General case' 0 C--N 1.4 2.778 0 C-N-CA 126.393 1.877 . . . . 0.0 114.727 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -64.32 -50.1 69.16 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 111.714 -2.494 . . . . 0.0 110.704 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.83 -15.33 48.68 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.463 -1.698 . . . . 0.0 113.68 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.754 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 72.0 mt-30 -67.73 -40.97 84.14 Favored 'General case' 0 C--N 1.406 3.05 0 CA-C-N 119.472 1.033 . . . . 0.0 110.177 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -74.07 -24.55 59.52 Favored 'General case' 0 C--N 1.387 2.204 0 C-N-CA 125.254 1.422 . . . . 0.0 112.834 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -43.78 27.12 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 112.627 -2.079 . . . . 0.0 110.333 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.24 -43.98 76.7 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 124.928 1.291 . . . . 0.0 112.672 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.25 -38.06 71.94 Favored 'General case' 0 C--N 1.385 2.138 0 C-N-CA 126.818 2.047 . . . . 0.0 111.721 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.3 -27.81 73.58 Favored Glycine 0 C--N 1.391 3.602 0 CA-C-N 120.231 1.378 . . . . 0.0 113.847 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.4 mtm180 -73.54 -26.62 60.93 Favored 'General case' 0 C--N 1.383 2.044 0 C-N-CA 125.345 1.458 . . . . 0.0 108.366 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.85 -37.37 93.28 Favored Glycine 1 C--N 1.403 4.264 0 CA-C-O 119.072 -0.849 . . . . 0.0 115.193 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 64.2 m -59.04 -48.08 82.88 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 125.925 1.69 . . . . 0.0 112.885 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 68.2 m -54.75 -67.54 0.26 Allowed 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 127.414 2.286 . . . . 0.0 113.404 175.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.271 3.2 mm? -73.03 -15.13 61.52 Favored 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.86 46.27 24.04 Favored Glycine 0 C--N 1.359 1.819 0 N-CA-C 117.531 1.772 . . . . 0.0 117.531 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.87 132.63 54.67 Favored 'General case' 0 C--O 1.259 1.557 0 CA-C-N 119.234 1.517 . . . . 0.0 108.61 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.64 120.61 13.25 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.309 0.576 . . . . 0.0 109.705 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.545 ' O ' HG23 ' B' ' 158' ' ' THR 0.266 0.9 OUTLIER -53.93 -48.0 63.78 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.282 0 C-N-CA 126.666 1.987 . . . . 0.0 114.573 -178.331 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -61.42 -44.4 97.18 Favored 'General case' 0 N--CA 1.521 3.108 0 CA-C-N 119.544 1.066 . . . . 0.0 112.92 176.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -69.71 -31.39 69.37 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.729 176.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.46 66.68 Favored 'General case' 0 C--N 1.378 1.841 0 O-C-N 124.643 1.214 . . . . 0.0 111.804 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.545 HG23 ' O ' ' B' ' 154' ' ' ILE . 69.5 p -66.11 -12.82 58.14 Favored 'General case' 0 N--CA 1.524 3.248 0 CA-C-O 122.561 1.172 . . . . 0.0 113.272 176.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -108.72 -40.74 4.98 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 111.522 -2.581 . . . . 0.0 110.018 -172.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.64 71.75 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 126.367 1.867 . . . . 0.0 109.98 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -70.77 -30.04 68.76 Favored Glycine 0 C--N 1.392 3.694 0 CA-C-O 117.906 -1.497 . . . . 0.0 114.518 175.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -47.93 -45.84 31.4 Favored 'General case' 0 N--CA 1.507 2.422 0 CA-C-N 117.735 0.767 . . . . 0.0 111.13 169.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -69.94 -35.9 74.88 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 124.595 1.158 . . . . 0.0 111.574 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 6.1 mt -79.34 8.36 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.527 3.417 0 C-N-CA 125.743 1.617 . . . . 0.0 112.476 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.7 t -110.5 -40.38 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.249 0 C-N-CA 125.588 1.555 . . . . 0.0 107.008 174.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.31 -48.01 79.85 Favored 'General case' 0 CA--C 1.59 2.519 0 CA-C-N 111.966 -2.379 . . . . 0.0 107.999 175.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.16 -45.18 61.49 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 110.991 -2.822 . . . . 0.0 110.902 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.4 OUTLIER -50.35 -30.31 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.52 3.043 0 CA-C-N 123.843 3.02 . . . . 0.0 117.832 173.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.5 9.18 23.24 Favored 'General case' 0 C--N 1.395 2.576 0 CA-C-N 117.933 0.333 . . . . 0.0 111.425 -175.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -121.89 -19.23 6.78 Favored 'General case' 0 CA--C 1.593 2.633 0 CA-C-O 122.561 1.172 . . . . 0.0 107.879 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -87.43 12.51 12.0 Favored 'General case' 0 N--CA 1.522 3.173 0 C-N-CA 128.888 2.875 . . . . 0.0 114.067 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -100.09 -13.33 19.05 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.378 1.834 0 CA-C-O 118.418 -0.801 . . . . 0.0 112.069 -178.775 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.83 159.69 18.07 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 125.134 1.374 . . . . 0.0 111.496 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.9 m -85.04 3.49 38.43 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.657 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 2.2 m120 -80.31 -14.3 58.49 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 124.834 1.254 . . . . 0.0 110.53 174.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 m -89.65 -18.23 26.88 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 126.158 1.783 . . . . 0.0 107.854 175.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.9 -37.8 11.61 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.864 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.9 m -68.83 -34.69 75.92 Favored 'General case' 0 C--N 1.391 2.372 0 C-N-CA 124.552 1.141 . . . . 0.0 112.156 173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.0 m -73.94 -16.3 61.1 Favored 'General case' 0 C--N 1.396 2.616 0 C-N-CA 124.636 1.174 . . . . 0.0 112.331 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -87.11 -36.67 17.97 Favored 'General case' 0 CA--C 1.578 2.034 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.89 -36.94 83.42 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 124.777 1.231 . . . . 0.0 112.893 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.544 HG12 HG22 ' A' ' 65' ' ' VAL . 0.2 OUTLIER -71.26 -37.95 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.789 174.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.89 -31.18 71.61 Favored 'General case' 0 C--N 1.383 2.031 0 CA-C-O 118.454 -0.784 . . . . 0.0 112.784 176.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.4 m -68.86 -40.26 79.43 Favored 'General case' 0 C--N 1.394 2.515 0 C-N-CA 123.061 0.544 . . . . 0.0 111.339 176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -70.28 -48.35 57.17 Favored 'General case' 0 C--N 1.389 2.288 0 C-N-CA 124.505 1.122 . . . . 0.0 109.902 175.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD11 HG11 ' B' ' 118' ' ' VAL . 6.1 mp -61.91 -38.35 88.07 Favored 'General case' 0 C--N 1.383 2.031 0 O-C-N 124.219 0.949 . . . . 0.0 112.823 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.718 ' HE1' ' HG2' ' A' ' 40' ' ' GLN . 78.6 t90 -64.82 -36.13 83.34 Favored 'General case' 0 CA--C 1.578 2.023 0 CA-C-O 117.666 -1.159 . . . . 0.0 113.017 170.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -74.92 -22.16 58.78 Favored 'General case' 0 C--N 1.394 2.542 0 CA-C-N 120.249 1.386 . . . . 0.0 109.208 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.495 HG11 HD11 ' B' ' 115' ' ' LEU . 54.1 t -71.56 -40.32 71.31 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.871 0 O-C-N 125.382 1.676 . . . . 0.0 106.997 174.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -77.44 -26.32 51.43 Favored 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 123.475 0.71 . . . . 0.0 111.556 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -86.79 -13.81 44.05 Favored 'General case' 0 C--N 1.405 2.987 0 CA-C-N 118.656 0.662 . . . . 0.0 112.768 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -86.95 -19.58 28.56 Favored 'General case' 0 N--CA 1.514 2.771 0 C-N-CA 127.843 2.457 . . . . 0.0 106.805 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.28 -43.18 13.96 Favored 'General case' 0 CA--C 1.576 1.962 0 C-N-CA 125.728 1.611 . . . . 0.0 109.34 172.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.25 -46.03 78.51 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -9.71 58.92 Favored 'General case' 0 N--CA 1.517 2.881 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -104.37 -7.55 19.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 128.263 2.625 . . . . 0.0 110.416 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.254 11.7 mt-10 64.23 51.52 2.13 Favored 'General case' 0 N--CA 1.525 3.286 0 C-N-CA 127.874 2.47 . . . . 0.0 112.848 -178.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mt -106.71 126.5 52.36 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 112.466 -2.152 . . . . 0.0 109.768 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 99.18 -172.06 25.06 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 112.432 -2.167 . . . . 0.0 109.531 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.7 -170.65 1.79 Allowed 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 120.007 1.903 . . . . 0.0 109.369 178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.93 57.7 Favored Pre-proline 0 CA--C 1.593 2.626 0 CA-C-O 115.571 -2.157 . . . . 0.0 116.802 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -61.22 -21.69 72.45 Favored 'Trans proline' 1 C--N 1.464 6.612 0 CA-C-N 124.668 2.703 . . . . 0.0 116.631 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.01 -43.91 86.31 Favored 'General case' 0 C--N 1.395 2.565 0 C-N-CA 124.336 1.055 . . . . 0.0 110.997 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -38.97 89.46 Favored 'General case' 0 N--CA 1.519 2.986 0 C-N-CA 126.832 2.053 . . . . 0.0 111.804 173.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.62 -51.11 71.29 Favored 'General case' 0 N--CA 1.521 3.08 0 C-N-CA 126.292 1.837 . . . . 0.0 112.015 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -62.66 -44.08 97.18 Favored 'General case' 0 C--N 1.393 2.466 0 C-N-CA 127.1 2.16 . . . . 0.0 112.18 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -55.98 -46.98 78.5 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 177.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -60.07 -42.13 93.9 Favored 'General case' 0 C--N 1.401 2.832 0 C-N-CA 126.631 1.972 . . . . 0.0 114.997 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -62.81 -47.63 82.6 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 126.657 2.473 . . . . 0.0 110.336 -177.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.16 -17.19 37.97 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 112.911 -1.95 . . . . 0.0 113.582 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.718 ' HG2' ' HE1' ' A' ' 16' ' ' TRP . 61.5 mt-30 -66.45 -40.63 89.54 Favored 'General case' 0 C--N 1.408 3.118 0 CA-C-N 119.699 1.136 . . . . 0.0 110.769 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -72.84 -27.83 62.17 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.705 1.602 . . . . 0.0 112.226 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.6 m -74.68 -44.04 52.19 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.175 -2.284 . . . . 0.0 110.992 -178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mt -68.93 -42.23 77.02 Favored 'General case' 0 C--N 1.385 2.112 0 C-N-CA 126.032 1.733 . . . . 0.0 113.153 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -73.12 -38.8 66.19 Favored 'General case' 0 C--N 1.381 1.942 0 C-N-CA 127.305 2.242 . . . . 0.0 112.315 176.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.85 -24.32 76.44 Favored Glycine 0 C--N 1.393 3.698 0 CA-C-N 120.097 1.317 . . . . 0.0 113.828 175.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -74.99 -27.5 60.17 Favored 'General case' 0 C--N 1.382 2.004 0 C-N-CA 125.243 1.417 . . . . 0.0 108.789 173.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.96 94.02 Favored Glycine 1 C--N 1.402 4.248 0 CA-C-O 119.338 -0.701 . . . . 0.0 114.645 173.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.2 m -59.73 -49.54 77.33 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 126.039 1.736 . . . . 0.0 113.274 178.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -60.22 3.95 Favored 'General case' 0 N--CA 1.513 2.725 0 C-N-CA 126.712 2.005 . . . . 0.0 115.311 177.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.251 1.7 mp -78.27 -13.59 59.79 Favored 'General case' 0 N--CA 1.516 2.844 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 177.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.76 47.47 26.07 Favored Glycine 0 C--N 1.364 2.099 0 N-CA-C 117.92 1.928 . . . . 0.0 117.92 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.2 mp -122.15 133.95 54.74 Favored 'General case' 0 C--O 1.257 1.486 0 CA-C-N 119.211 1.506 . . . . 0.0 108.972 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.0 119.73 14.65 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.705 0.764 . . . . 0.0 109.312 175.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.574 ' O ' HG23 ' A' ' 58' ' ' THR 0.269 0.5 OUTLIER -55.54 -43.82 74.0 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.021 0 C-N-CA 127.156 2.182 . . . . 0.0 115.661 -176.06 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -61.68 -42.18 98.58 Favored 'General case' 0 N--CA 1.522 3.159 0 CA-C-N 119.63 1.105 . . . . 0.0 113.538 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.69 -31.46 61.9 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.982 1.313 . . . . 0.0 109.753 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.87 -29.35 64.27 Favored 'General case' 0 C--N 1.377 1.771 0 O-C-N 124.376 1.047 . . . . 0.0 111.696 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 54' ' ' ILE . 34.9 p -66.36 -18.67 65.49 Favored 'General case' 0 C--N 1.411 3.277 0 CA-C-O 122.992 1.377 . . . . 0.0 111.979 174.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.1 mtt180 -99.07 -43.57 6.62 Favored 'General case' 0 N--CA 1.516 2.825 0 CA-C-N 111.134 -2.757 . . . . 0.0 111.146 -174.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.93 87.81 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 112.541 -2.118 . . . . 0.0 110.065 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.568 ' HA2' HG12 ' A' ' 64' ' ' ILE . . . -73.87 -28.15 65.41 Favored Glycine 0 C--N 1.394 3.768 0 CA-C-O 116.628 -2.207 . . . . 0.0 114.97 173.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -46.99 -47.13 22.02 Favored 'General case' 0 N--CA 1.511 2.612 0 CA-C-N 119.409 1.605 . . . . 0.0 112.122 170.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 52.4 mt-30 -67.76 -37.25 81.86 Favored 'General case' 0 C--N 1.392 2.421 0 C-N-CA 125.364 1.466 . . . . 0.0 112.364 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.695 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.41 0.6 OUTLIER -75.43 -14.16 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 C-N-CA 125.269 1.428 . . . . 0.0 113.735 -179.745 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.544 HG22 HG12 ' A' ' 11' ' ' VAL . 91.2 t -93.14 -57.88 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.82 0 C-N-CA 125.328 1.451 . . . . 0.0 108.471 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -55.26 -72.63 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 126.165 2.166 . . . . 0.0 109.988 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 7.5 mtm180 -51.44 -33.97 33.13 Favored 'General case' 0 C--N 1.392 2.442 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.695 ' HB ' ' O ' ' A' ' 64' ' ' ILE . 0.0 OUTLIER -74.62 -19.12 16.72 Favored 'Isoleucine or valine' 0 C--N 1.407 3.096 0 CA-C-N 122.275 2.307 . . . . 0.0 113.214 177.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.29 -5.06 55.26 Favored 'General case' 0 C--N 1.392 2.414 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 ttmt -103.35 -20.32 14.13 Favored 'General case' 0 CA--C 1.586 2.354 0 CA-C-N 113.404 -1.726 . . . . 0.0 108.766 177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -67.83 -40.96 83.7 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 111.371 -2.65 . . . . 0.0 111.73 -176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 48.58 22.64 0.52 Allowed 'General case' 0 N--CA 1.538 3.944 0 C-N-CA 125.702 1.601 . . . . 0.0 113.379 175.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.371 1.538 0 C-N-CA 125.275 1.43 . . . . 0.0 111.808 -169.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 6.7 mtt . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.53 159.87 17.7 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 124.97 1.308 . . . . 0.0 111.335 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 69.1 m -85.21 3.95 36.91 Favored 'General case' 0 N--CA 1.505 2.291 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.667 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 2.2 m120 -81.09 -12.2 59.33 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 124.814 1.245 . . . . 0.0 110.635 174.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 2.8 m -92.93 -16.6 24.98 Favored 'General case' 0 CA--C 1.579 2.065 0 C-N-CA 126.221 1.808 . . . . 0.0 107.607 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 59.9 t -88.23 -37.59 10.66 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.751 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 73.7 m -69.27 -34.34 74.6 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 124.506 1.122 . . . . 0.0 112.168 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.0 m -75.44 -13.15 60.37 Favored 'General case' 0 C--N 1.398 2.678 0 CA-C-N 119.543 1.065 . . . . 0.0 112.614 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -89.31 -36.62 15.45 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -66.95 -36.93 83.32 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 124.766 1.227 . . . . 0.0 112.835 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . 0.545 HG12 HG22 ' B' ' 165' ' ' VAL . 0.2 OUTLIER -71.32 -38.26 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.741 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -31.18 71.69 Favored 'General case' 0 C--N 1.383 2.051 0 CA-C-N 118.934 0.788 . . . . 0.0 112.798 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 94.3 m -68.95 -40.25 79.06 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -70.27 -48.32 57.29 Favored 'General case' 0 C--N 1.388 2.278 0 C-N-CA 124.52 1.128 . . . . 0.0 109.943 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.495 HD11 HG11 ' A' ' 18' ' ' VAL . 6.1 mp -61.85 -38.39 88.07 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 124.209 0.943 . . . . 0.0 112.844 -178.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.706 ' HE1' ' HG2' ' B' ' 140' ' ' GLN . 78.6 t90 -64.84 -36.02 83.01 Favored 'General case' 0 CA--C 1.579 2.071 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.037 170.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -74.83 -22.48 58.68 Favored 'General case' 0 N--CA 1.51 2.536 0 CA-C-N 120.258 1.39 . . . . 0.0 109.208 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . 0.468 HG11 HD11 ' A' ' 15' ' ' LEU . 54.8 t -71.15 -40.31 74.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 O-C-N 125.489 1.743 . . . . 0.0 107.066 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -77.67 -25.91 49.92 Favored 'General case' 0 CA--C 1.581 2.135 0 C-N-CA 123.409 0.683 . . . . 0.0 111.51 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -89.1 -8.8 53.12 Favored 'General case' 0 C--N 1.408 3.139 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -90.76 -19.23 23.74 Favored 'General case' 0 N--CA 1.511 2.624 0 C-N-CA 128.192 2.597 . . . . 0.0 106.529 173.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -85.75 -43.19 13.56 Favored 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 125.66 1.584 . . . . 0.0 109.292 172.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.01 78.16 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.57 -9.91 59.15 Favored 'General case' 0 N--CA 1.516 2.859 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -104.28 -7.43 20.03 Favored 'General case' 0 N--CA 1.497 1.877 0 C-N-CA 128.274 2.629 . . . . 0.0 110.485 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.258 11.8 mt-10 64.33 51.76 2.02 Favored 'General case' 0 N--CA 1.523 3.202 0 C-N-CA 127.856 2.463 . . . . 0.0 112.954 -179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.4 mt -107.16 126.84 52.91 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 112.567 -2.106 . . . . 0.0 109.866 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.657 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 98.79 -172.01 25.48 Favored Glycine 0 C--O 1.25 1.095 0 CA-C-N 112.405 -2.18 . . . . 0.0 109.53 -174.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.57 -170.75 1.81 Allowed 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 120.149 1.974 . . . . 0.0 109.367 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.03 59.58 Favored Pre-proline 0 CA--C 1.593 2.632 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -61.04 -21.66 72.26 Favored 'Trans proline' 1 C--N 1.463 6.604 0 CA-C-N 124.623 2.687 . . . . 0.0 116.716 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.26 -43.79 85.48 Favored 'General case' 0 C--N 1.395 2.553 0 C-N-CA 124.195 0.998 . . . . 0.0 110.969 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -38.95 89.33 Favored 'General case' 0 N--CA 1.518 2.956 0 C-N-CA 126.834 2.053 . . . . 0.0 111.823 173.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.57 -51.2 70.91 Favored 'General case' 0 N--CA 1.52 3.071 0 C-N-CA 126.224 1.81 . . . . 0.0 112.03 172.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -62.56 -44.04 97.31 Favored 'General case' 0 C--N 1.393 2.498 0 C-N-CA 127.05 2.14 . . . . 0.0 112.316 177.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.576 ' O ' ' HG3' ' B' ' 140' ' ' GLN . 0.4 OUTLIER -55.96 -47.05 78.32 Favored 'General case' 0 C--N 1.386 2.194 0 N-CA-C 116.461 2.023 . . . . 0.0 116.461 177.443 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.88 -42.24 93.32 Favored 'General case' 0 C--N 1.4 2.788 0 C-N-CA 126.666 1.986 . . . . 0.0 115.057 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 42.4 mtm180 -62.79 -47.73 82.2 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 111.609 -2.541 . . . . 0.0 110.355 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.48 -16.29 40.1 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.688 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.706 ' HG2' ' HE1' ' B' ' 116' ' ' TRP . 61.4 mt-30 -66.82 -40.73 88.12 Favored 'General case' 0 C--N 1.408 3.133 0 CA-C-N 119.67 1.123 . . . . 0.0 110.763 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -72.63 -27.87 62.4 Favored 'General case' 0 N--CA 1.501 2.124 0 C-N-CA 125.682 1.593 . . . . 0.0 112.341 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 75.1 m -74.73 -44.0 52.14 Favored 'General case' 0 C--N 1.391 2.413 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.052 -178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 mt -68.88 -42.23 77.24 Favored 'General case' 0 C--N 1.385 2.123 0 C-N-CA 126.017 1.727 . . . . 0.0 113.204 178.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -73.32 -38.69 65.73 Favored 'General case' 0 C--N 1.381 1.951 0 C-N-CA 127.345 2.258 . . . . 0.0 112.237 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.71 -24.45 76.28 Favored Glycine 0 C--N 1.392 3.648 0 CA-C-N 120.221 1.373 . . . . 0.0 113.811 175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -74.97 -27.56 60.22 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.337 -1.431 . . . . 0.0 108.682 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -63.68 -37.13 94.27 Favored Glycine 1 C--N 1.403 4.253 0 CA-C-O 119.254 -0.748 . . . . 0.0 114.783 173.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 61.4 m -59.44 -49.31 78.3 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 126.052 1.741 . . . . 0.0 113.167 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.23 -69.47 0.12 Allowed 'General case' 0 N--CA 1.514 2.729 0 C-N-CA 127.328 2.251 . . . . 0.0 114.423 176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 1.7 mp -71.96 -15.16 62.07 Favored 'General case' 0 N--CA 1.518 2.936 0 O-C-N 123.801 0.688 . . . . 0.0 112.549 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.97 50.98 11.14 Favored Glycine 0 C--N 1.366 2.222 0 N-CA-C 118.02 1.968 . . . . 0.0 118.02 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.2 mp -124.25 134.11 53.33 Favored 'General case' 0 C--O 1.257 1.485 0 CA-C-N 118.959 1.379 . . . . 0.0 108.915 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.13 119.62 14.6 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.722 0.773 . . . . 0.0 109.306 175.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.575 ' O ' HG23 ' B' ' 158' ' ' THR 0.27 0.5 OUTLIER -55.09 -44.16 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.071 0 C-N-CA 127.115 2.166 . . . . 0.0 115.721 -176.071 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -61.45 -42.59 99.0 Favored 'General case' 0 N--CA 1.523 3.185 0 CA-C-N 119.584 1.084 . . . . 0.0 113.473 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -31.36 62.81 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.98 1.312 . . . . 0.0 109.704 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.28 -28.94 63.43 Favored 'General case' 0 C--N 1.376 1.729 0 O-C-N 124.488 1.118 . . . . 0.0 111.557 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.575 HG23 ' O ' ' B' ' 154' ' ' ILE . 34.6 p -68.44 -11.1 59.25 Favored 'General case' 0 C--N 1.413 3.366 0 CA-C-O 122.8 1.286 . . . . 0.0 112.61 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -109.13 -41.69 4.62 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 111.766 -2.47 . . . . 0.0 110.388 -173.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.24 85.39 Favored 'General case' 0 C--N 1.378 1.816 0 C-N-CA 126.204 1.802 . . . . 0.0 109.738 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . 0.532 ' HA2' HG12 ' B' ' 164' ' ' ILE . . . -73.33 -29.15 64.62 Favored Glycine 0 C--N 1.396 3.863 0 CA-C-O 116.667 -2.185 . . . . 0.0 115.121 173.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -46.31 -46.94 18.44 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.316 1.558 . . . . 0.0 112.015 170.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.506 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 52.4 mt-30 -67.99 -37.13 81.11 Favored 'General case' 0 C--N 1.389 2.316 0 C-N-CA 125.35 1.46 . . . . 0.0 112.364 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.55 ' O ' ' HB ' ' B' ' 168' ' ' ILE 0.334 0.6 OUTLIER -79.83 -1.1 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.718 0 C-N-CA 124.919 1.288 . . . . 0.0 114.339 -179.214 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . 0.545 HG22 HG12 ' B' ' 111' ' ' VAL . 87.9 t -106.04 -56.68 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.828 0 C-N-CA 126.063 1.745 . . . . 0.0 107.292 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -52.97 -80.22 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 126.307 2.254 . . . . 0.0 108.261 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 7.6 mtm180 -46.93 -33.8 4.93 Favored 'General case' 0 C--N 1.387 2.237 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 172.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' B' ' 164' ' ' ILE . 0.0 OUTLIER -76.07 -13.3 14.8 Favored 'Isoleucine or valine' 0 C--N 1.419 3.615 0 CA-C-N 122.857 2.571 . . . . 0.0 113.038 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.42 13.25 35.59 Favored 'General case' 0 C--N 1.396 2.625 0 CA-C-O 122.558 1.171 . . . . 0.0 107.843 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 16.7 ttmt -123.33 -18.53 6.22 Favored 'General case' 0 CA--C 1.575 1.933 0 CA-C-N 113.524 -1.671 . . . . 0.0 107.831 177.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.68 -49.04 67.42 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-N 111.149 -2.75 . . . . 0.0 109.715 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 53.37 21.42 2.35 Favored 'General case' 1 N--CA 1.539 4.006 0 C-N-CA 125.699 1.6 . . . . 0.0 112.787 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.366 1.325 0 C-N-CA 125.34 1.456 . . . . 0.0 111.852 -169.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 121.808 0.814 . . . . 0.0 111.492 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.56 46.11 1.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.636 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.4 m -78.42 -2.37 38.05 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -173.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.421 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 6.4 m120 -77.6 -23.62 49.84 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.151 0.58 . . . . 0.0 110.781 176.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.2 m -86.98 -20.66 26.94 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 125.368 1.467 . . . . 0.0 107.574 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -81.94 -37.67 15.15 Favored 'Isoleucine or valine' 0 C--N 1.369 1.426 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 67.3 m -66.5 -34.84 78.82 Favored 'General case' 0 C--N 1.39 2.344 0 C-N-CA 125.006 1.323 . . . . 0.0 111.072 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -74.87 -15.71 60.71 Favored 'General case' 0 C--N 1.396 2.615 0 C-N-CA 124.994 1.318 . . . . 0.0 111.304 174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -88.7 -41.08 12.8 Favored 'General case' 0 C--N 1.382 2.013 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -66.14 -37.86 86.74 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.723 1.609 . . . . 0.0 111.223 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.8 -39.47 68.15 Favored 'Isoleucine or valine' 0 C--N 1.375 1.688 0 C-N-CA 125.629 1.572 . . . . 0.0 109.827 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -27.48 67.06 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 119.362 0.983 . . . . 0.0 111.425 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.6 m -68.06 -39.21 83.06 Favored 'General case' 0 C--N 1.397 2.648 0 C-N-CA 124.334 1.053 . . . . 0.0 110.298 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -72.28 -48.67 40.62 Favored 'General case' 0 C--N 1.385 2.145 0 C-N-CA 124.372 1.069 . . . . 0.0 110.353 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.4 -34.95 79.37 Favored 'General case' 0 C--N 1.385 2.111 0 C-N-CA 124.338 1.055 . . . . 0.0 112.549 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.628 ' HE1' ' HA ' ' A' ' 40' ' ' GLN . 3.3 t-105 -70.42 -25.89 63.42 Favored 'General case' 0 C--N 1.378 1.825 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 170.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.5 t60 -84.58 -21.46 30.39 Favored 'General case' 0 CA--C 1.579 2.093 0 CA-C-N 118.985 0.811 . . . . 0.0 109.144 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.8 t -73.7 -43.27 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 C-N-CA 125.775 1.63 . . . . 0.0 107.613 175.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.31 -26.97 56.36 Favored 'General case' 0 CA--C 1.58 2.1 0 C-N-CA 124.186 0.994 . . . . 0.0 111.524 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -83.75 -12.64 55.47 Favored 'General case' 0 N--CA 1.517 2.893 0 C-N-CA 124.723 1.209 . . . . 0.0 112.774 176.466 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -89.47 -21.72 22.84 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 128.386 2.674 . . . . 0.0 107.466 174.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.08 -49.52 8.2 Favored 'General case' 0 CA--C 1.577 2.002 0 C-N-CA 126.176 1.79 . . . . 0.0 110.267 174.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.05 -41.9 94.73 Favored 'General case' 0 N--CA 1.509 2.493 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -70.97 -5.26 29.65 Favored 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -107.66 -11.62 15.4 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 128.955 2.902 . . . . 0.0 110.605 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.267 9.0 mt-10 66.59 40.98 3.22 Favored 'General case' 0 N--CA 1.519 2.996 0 C-N-CA 127.696 2.398 . . . . 0.0 112.985 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.35 119.17 31.14 Favored 'General case' 0 C--O 1.255 1.351 0 CA-C-N 112.965 -1.925 . . . . 0.0 108.71 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 105.25 -165.98 14.39 Favored Glycine 0 C--O 1.248 0.983 0 CA-C-N 112.78 -2.009 . . . . 0.0 108.538 -173.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.93 -178.72 3.94 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-N 119.836 1.818 . . . . 0.0 108.655 176.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.57 -35.97 40.42 Favored Pre-proline 0 CA--C 1.598 2.803 0 N-CA-C 116.624 2.083 . . . . 0.0 116.624 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_exo -57.95 -16.05 24.72 Favored 'Trans proline' 1 C--N 1.458 6.292 0 CA-C-N 123.68 2.35 . . . . 0.0 116.486 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.57 -40.46 88.99 Favored 'General case' 0 C--N 1.393 2.489 0 C-N-CA 123.514 0.725 . . . . 0.0 110.691 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.77 -37.28 86.8 Favored 'General case' 0 N--CA 1.515 2.791 0 C-N-CA 126.17 1.788 . . . . 0.0 111.723 172.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.44 -50.87 72.27 Favored 'General case' 0 N--CA 1.528 3.442 0 C-N-CA 125.373 1.469 . . . . 0.0 111.612 172.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.67 -43.3 99.15 Favored 'General case' 0 C--N 1.399 2.753 0 C-N-CA 126.769 2.028 . . . . 0.0 111.078 177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -43.72 80.56 Favored 'General case' 0 C--N 1.385 2.147 0 N-CA-C 116.908 2.188 . . . . 0.0 116.908 176.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -59.34 -50.02 75.57 Favored 'General case' 0 C--N 1.389 2.29 0 C-N-CA 124.646 1.178 . . . . 0.0 113.469 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -60.45 -49.17 78.63 Favored 'General case' 0 C--N 1.407 3.066 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -19.88 48.16 Favored 'General case' 0 C--N 1.393 2.475 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.628 ' HA ' ' HE1' ' A' ' 16' ' ' TRP . 12.3 tt0 -68.2 -40.44 82.17 Favored 'General case' 0 C--N 1.393 2.474 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.256 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -72.55 -24.33 61.11 Favored 'General case' 0 C--N 1.386 2.173 0 C-N-CA 126.505 1.922 . . . . 0.0 112.57 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t -78.29 -45.03 23.79 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 111.882 -2.417 . . . . 0.0 110.135 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.02 84.66 Favored 'General case' 0 C--N 1.39 2.362 0 C-N-CA 125.329 1.452 . . . . 0.0 112.703 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.62 -38.21 70.81 Favored 'General case' 0 C--N 1.385 2.117 0 C-N-CA 126.539 1.936 . . . . 0.0 111.867 177.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.55 -25.78 74.49 Favored Glycine 0 C--N 1.392 3.692 0 CA-C-N 119.76 1.164 . . . . 0.0 114.175 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -74.66 -26.16 59.68 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 124.974 1.31 . . . . 0.0 107.91 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.21 -38.25 94.96 Favored Glycine 1 C--N 1.403 4.25 0 N-CA-C 114.957 0.743 . . . . 0.0 114.957 172.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -59.71 -48.36 81.97 Favored 'General case' 0 N--CA 1.499 1.981 0 C-N-CA 126.296 1.839 . . . . 0.0 113.165 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.3 m -57.0 -57.6 11.83 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 126.622 1.969 . . . . 0.0 114.124 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.271 3.9 mm? -80.65 -11.31 59.65 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 177.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.44 43.88 52.57 Favored Glycine 0 C--N 1.361 1.919 0 N-CA-C 116.687 1.435 . . . . 0.0 116.687 173.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.45 135.44 55.05 Favored 'General case' 0 C--O 1.259 1.577 0 CA-C-N 118.903 1.352 . . . . 0.0 109.086 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.74 118.55 13.66 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.267 0.556 . . . . 0.0 109.503 174.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -40.83 45.29 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.428 0 C-N-CA 126.833 2.053 . . . . 0.0 114.602 -178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -63.84 -44.85 91.96 Favored 'General case' 0 N--CA 1.521 3.08 0 CA-C-N 119.953 1.251 . . . . 0.0 112.556 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.51 -37.75 65.57 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 123.834 0.854 . . . . 0.0 112.283 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.33 86.25 Favored 'General case' 0 C--N 1.389 2.316 0 O-C-N 124.321 1.013 . . . . 0.0 111.606 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -53.78 -53.09 57.14 Favored 'General case' 0 C--N 1.396 2.597 0 O-C-N 124.376 1.048 . . . . 0.0 111.093 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.53 -41.43 94.41 Favored 'General case' 0 N--CA 1.521 3.112 0 O-C-N 126.36 2.288 . . . . 0.0 113.222 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.37 -50.73 70.4 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 126.357 1.863 . . . . 0.0 111.284 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.47 -25.97 68.99 Favored Glycine 0 C--N 1.391 3.597 0 CA-C-O 117.228 -1.874 . . . . 0.0 114.6 175.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -48.04 -46.74 33.63 Favored 'General case' 0 N--CA 1.508 2.457 0 CA-C-N 118.412 1.106 . . . . 0.0 111.111 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 70.3 mt-30 -65.08 -34.66 78.95 Favored 'General case' 0 C--N 1.391 2.397 0 C-N-CA 125.4 1.48 . . . . 0.0 110.681 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.672 ' O ' ' HB ' ' A' ' 68' ' ' ILE . 13.0 mt -77.09 -18.12 14.48 Favored 'Isoleucine or valine' 0 CA--C 1.603 2.982 0 C-N-CA 124.679 1.192 . . . . 0.0 111.264 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.8 t -91.81 -61.19 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.852 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.04 -71.78 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 126.355 2.285 . . . . 0.0 110.183 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 6.3 mtt180 -52.23 -39.82 60.78 Favored 'General case' 0 C--N 1.398 2.692 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.672 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.298 0.6 OUTLIER -65.64 -18.14 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.528 3.451 0 CA-C-N 122.578 2.445 . . . . 0.0 115.149 -179.657 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.7 mp -89.79 -31.92 17.18 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -80.87 -14.6 57.88 Favored 'General case' 0 N--CA 1.52 3.071 0 CA-C-O 123.733 1.73 . . . . 0.0 112.078 176.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' ARG . 3.2 mt-10 -92.49 16.58 11.6 Favored 'General case' 0 N--CA 1.515 2.781 0 CA-C-N 109.828 -3.351 . . . . 0.0 113.978 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -97.07 -12.89 22.64 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.503 0.721 . . . . 0.0 112.898 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.373 1.606 0 C-N-CA 124.249 1.02 . . . . 0.0 111.976 -179.428 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 121.876 0.846 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.22 45.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.432 178.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 62.5 m -78.5 -2.23 37.64 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 -173.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 6.5 m120 -77.96 -22.98 48.64 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 123.096 0.558 . . . . 0.0 110.692 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 10.3 m -87.59 -21.4 25.39 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 125.411 1.485 . . . . 0.0 107.535 176.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 57.5 t -81.49 -37.53 15.53 Favored 'Isoleucine or valine' 0 C--N 1.368 1.402 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 66.5 m -66.93 -33.72 76.2 Favored 'General case' 0 C--N 1.391 2.379 0 C-N-CA 124.943 1.297 . . . . 0.0 111.077 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 61.3 m -77.27 -11.23 59.8 Favored 'General case' 0 C--N 1.4 2.781 0 C-N-CA 124.656 1.182 . . . . 0.0 111.444 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -92.55 -40.89 10.55 Favored 'General case' 0 C--N 1.38 1.905 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.3 -37.85 86.38 Favored 'General case' 0 N--CA 1.511 2.595 0 C-N-CA 125.639 1.575 . . . . 0.0 111.083 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.8 t -71.88 -39.9 68.01 Favored 'Isoleucine or valine' 0 C--N 1.376 1.753 0 C-N-CA 125.577 1.551 . . . . 0.0 109.756 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.99 -27.63 67.6 Favored 'General case' 0 C--N 1.391 2.395 0 CA-C-N 119.452 1.023 . . . . 0.0 111.509 173.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 97.8 m -67.99 -39.13 83.33 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 124.294 1.038 . . . . 0.0 110.361 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -72.33 -48.62 40.61 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.327 1.051 . . . . 0.0 110.367 176.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mp -64.29 -35.17 79.96 Favored 'General case' 0 C--N 1.384 2.097 0 C-N-CA 124.177 0.991 . . . . 0.0 112.522 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.654 ' HE1' ' HA ' ' B' ' 140' ' ' GLN . 3.1 t-105 -70.15 -26.4 63.92 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 170.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -84.03 -21.97 31.45 Favored 'General case' 0 CA--C 1.58 2.111 0 CA-C-N 119.113 0.87 . . . . 0.0 109.146 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.29 -43.13 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 C-N-CA 125.808 1.643 . . . . 0.0 107.59 175.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -76.38 -26.84 56.03 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 124.111 0.964 . . . . 0.0 111.507 175.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 116' ' ' TRP . 0.4 OUTLIER -86.15 -6.24 59.04 Favored 'General case' 0 C--N 1.406 3.047 0 C-N-CA 124.226 1.01 . . . . 0.0 113.062 176.643 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -94.85 -21.43 18.68 Favored 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 128.86 2.864 . . . . 0.0 107.101 173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.49 -49.26 8.21 Favored 'General case' 0 CA--C 1.576 1.961 0 C-N-CA 125.941 1.696 . . . . 0.0 110.087 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -65.48 -41.88 92.81 Favored 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.3 OUTLIER -71.81 -2.96 19.56 Favored 'General case' 0 N--CA 1.519 3.005 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -109.55 -11.66 14.77 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 129.077 2.951 . . . . 0.0 110.593 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.267 9.1 mt-10 66.72 40.89 3.12 Favored 'General case' 0 N--CA 1.52 3.039 0 C-N-CA 127.633 2.373 . . . . 0.0 112.951 -177.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mt -91.44 119.32 31.32 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.021 -1.9 . . . . 0.0 108.622 177.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.421 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 105.3 -166.1 14.39 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.524 -173.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.92 -178.83 3.97 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-N 119.813 1.807 . . . . 0.0 108.656 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.58 -35.78 38.24 Favored Pre-proline 0 CA--C 1.598 2.824 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -59.27 -13.28 19.32 Favored 'Trans proline' 1 C--N 1.457 6.268 0 CA-C-N 123.761 2.379 . . . . 0.0 116.623 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -40.35 81.86 Favored 'General case' 0 C--N 1.394 2.508 0 C-N-CA 123.459 0.704 . . . . 0.0 110.54 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.85 -37.05 85.95 Favored 'General case' 0 N--CA 1.514 2.733 0 C-N-CA 126.129 1.772 . . . . 0.0 111.648 172.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -59.52 -50.94 71.97 Favored 'General case' 0 N--CA 1.529 3.477 0 C-N-CA 125.427 1.491 . . . . 0.0 111.576 171.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -62.69 -43.26 99.27 Favored 'General case' 0 C--N 1.398 2.709 0 C-N-CA 126.716 2.006 . . . . 0.0 111.075 177.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -43.88 80.78 Favored 'General case' 0 C--N 1.384 2.078 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -59.08 -50.21 74.94 Favored 'General case' 0 C--N 1.39 2.329 0 C-N-CA 124.652 1.181 . . . . 0.0 113.464 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -60.33 -49.24 78.37 Favored 'General case' 0 C--N 1.408 3.113 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.65 -19.89 48.05 Favored 'General case' 0 C--N 1.393 2.46 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -175.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.654 ' HA ' ' HE1' ' B' ' 116' ' ' TRP . 12.3 tt0 -68.11 -40.51 82.52 Favored 'General case' 0 C--N 1.393 2.466 0 CA-C-N 118.304 0.502 . . . . 0.0 111.253 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -72.44 -24.47 61.21 Favored 'General case' 0 C--N 1.386 2.19 0 C-N-CA 126.52 1.928 . . . . 0.0 112.577 177.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.4 t -78.24 -45.04 23.96 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-N 111.899 -2.409 . . . . 0.0 110.176 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.87 -43.12 84.37 Favored 'General case' 0 C--N 1.389 2.307 0 C-N-CA 125.352 1.461 . . . . 0.0 112.73 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -71.6 -38.15 70.89 Favored 'General case' 0 C--N 1.384 2.104 0 C-N-CA 126.467 1.907 . . . . 0.0 111.81 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.93 74.48 Favored Glycine 0 C--N 1.391 3.638 0 CA-C-N 119.769 1.168 . . . . 0.0 114.232 175.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -74.6 -26.18 59.74 Favored 'General case' 0 C--N 1.381 1.952 0 C-N-CA 124.929 1.292 . . . . 0.0 107.968 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -65.43 -38.23 94.66 Favored Glycine 1 C--N 1.402 4.219 0 N-CA-C 114.942 0.737 . . . . 0.0 114.942 172.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.3 m -59.47 -48.36 81.94 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.421 1.888 . . . . 0.0 112.978 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 29.0 m -53.15 -67.76 0.23 Allowed 'General case' 0 C--N 1.394 2.522 0 C-N-CA 127.455 2.302 . . . . 0.0 113.031 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.261 4.0 mm? -74.07 -11.56 60.35 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 72.01 43.39 49.08 Favored Glycine 0 C--N 1.362 1.973 0 N-CA-C 116.987 1.555 . . . . 0.0 116.987 173.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 1.5 mp -121.19 135.77 55.09 Favored 'General case' 0 C--O 1.258 1.531 0 CA-C-N 118.952 1.376 . . . . 0.0 109.197 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.82 118.55 13.74 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . 0.253 0.5 OUTLIER -53.7 -41.12 45.82 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.44 0 C-N-CA 126.901 2.081 . . . . 0.0 114.638 -178.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -63.73 -44.73 92.69 Favored 'General case' 0 N--CA 1.52 3.073 0 CA-C-N 119.98 1.264 . . . . 0.0 112.611 174.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.67 -37.66 65.18 Favored 'General case' 0 C--N 1.384 2.068 0 C-N-CA 123.926 0.89 . . . . 0.0 112.235 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.3 85.95 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 124.059 0.944 . . . . 0.0 111.581 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 7.7 m -53.85 -53.02 58.38 Favored 'General case' 0 C--N 1.396 2.598 0 O-C-N 124.348 1.03 . . . . 0.0 111.13 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -60.42 -41.27 93.62 Favored 'General case' 0 N--CA 1.521 3.083 0 O-C-N 126.314 2.259 . . . . 0.0 113.285 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.57 -50.66 70.43 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 126.27 1.828 . . . . 0.0 111.27 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.43 -26.08 68.81 Favored Glycine 0 C--N 1.39 3.541 0 CA-C-O 117.45 -1.75 . . . . 0.0 114.573 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -47.93 -46.53 32.16 Favored 'General case' 0 N--CA 1.506 2.352 0 CA-C-N 118.182 0.991 . . . . 0.0 111.079 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.656 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 71.0 mt-30 -65.07 -34.88 79.47 Favored 'General case' 0 C--N 1.389 2.286 0 C-N-CA 125.393 1.477 . . . . 0.0 110.622 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.569 ' O ' ' HB ' ' B' ' 168' ' ' ILE . 10.2 mt -79.66 -8.12 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.609 3.231 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.891 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 84.6 t -102.42 -59.48 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.7 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.1 -79.33 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 O-C-N 126.261 2.225 . . . . 0.0 108.397 176.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.656 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.2 mtt180 -47.85 -39.89 19.88 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-O 114.781 -2.533 . . . . 0.0 117.534 173.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' B' ' 164' ' ' ILE 0.271 0.6 OUTLIER -67.58 -11.51 14.11 Favored 'Isoleucine or valine' 0 C--N 1.419 3.606 0 CA-C-N 123.521 2.873 . . . . 0.0 115.518 -179.734 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.86 -30.99 13.36 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -81.53 -14.65 56.65 Favored 'General case' 0 N--CA 1.522 3.15 0 CA-C-O 123.622 1.677 . . . . 0.0 112.073 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 167' ' ' ARG . 3.2 mt-10 -91.25 15.56 11.7 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 109.845 -3.343 . . . . 0.0 114.05 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -96.74 -12.64 23.46 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -173.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.376 1.743 0 C-N-CA 124.316 1.046 . . . . 0.0 112.14 -179.123 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mtt . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 121.401 0.62 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -127.84 121.72 30.81 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.635 1.174 . . . . 0.0 112.539 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.263 6.5 m 73.96 -60.44 0.53 Allowed 'General case' 0 N--CA 1.533 3.719 0 C-N-CA 126.853 2.061 . . . . 0.0 116.275 175.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.542 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 4.0 m-80 -81.58 -24.31 36.59 Favored 'General case' 0 N--CA 1.507 2.381 0 CA-C-N 120.386 1.448 . . . . 0.0 113.545 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.85 -15.74 35.95 Favored 'General case' 0 N--CA 1.501 2.077 0 C-N-CA 124.899 1.28 . . . . 0.0 108.735 177.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 47.1 t -87.02 -36.33 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.546 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.1 m -68.22 -33.12 73.82 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.625 1.17 . . . . 0.0 111.613 174.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -76.16 -16.48 59.86 Favored 'General case' 0 C--N 1.396 2.595 0 C-N-CA 124.308 1.043 . . . . 0.0 111.897 174.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -88.93 -42.5 11.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-O 118.845 -0.598 . . . . 0.0 109.495 175.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -66.09 -38.85 89.28 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 125.51 1.524 . . . . 0.0 112.172 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.1 t -72.0 -39.2 66.09 Favored 'Isoleucine or valine' 0 C--N 1.379 1.877 0 C-N-CA 124.537 1.135 . . . . 0.0 110.719 175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 -26.99 66.73 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 119.011 0.823 . . . . 0.0 111.772 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 92.5 m -67.6 -38.78 84.46 Favored 'General case' 0 C--N 1.393 2.481 0 C-N-CA 123.937 0.895 . . . . 0.0 110.052 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' HA ' HG23 ' A' ' 58' ' ' THR . 45.4 t80 -69.88 -50.45 42.31 Favored 'General case' 0 C--N 1.389 2.293 0 C-N-CA 124.734 1.214 . . . . 0.0 110.33 175.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.56 -38.58 91.66 Favored 'General case' 0 C--N 1.38 1.923 0 C-N-CA 124.352 1.061 . . . . 0.0 113.528 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . 0.471 ' CH2' ' HB3' ' A' ' 40' ' ' GLN . 0.9 OUTLIER -70.15 -28.38 65.31 Favored 'General case' 0 CA--C 1.581 2.153 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 173.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -80.73 -21.16 41.39 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-N 119.809 1.186 . . . . 0.0 109.034 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.6 t -71.58 -39.86 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.05 0 O-C-N 125.394 1.684 . . . . 0.0 106.718 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -74.86 -27.1 60.12 Favored 'General case' 0 CA--C 1.578 2.057 0 C-N-CA 124.322 1.049 . . . . 0.0 112.168 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 19.6 tttt -86.75 -12.67 47.47 Favored 'General case' 0 C--N 1.396 2.626 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HD3' HD11 ' B' ' 169' ' ' LEU . 15.6 mtt180 -87.89 -19.95 26.65 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.424 2.69 . . . . 0.0 106.532 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -86.85 -49.51 7.36 Favored 'General case' 0 CA--C 1.578 2.048 0 C-N-CA 126.348 1.859 . . . . 0.0 110.587 173.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.28 89.93 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.8 OUTLIER -71.51 -6.55 41.42 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 178.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.09 -9.06 18.05 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 129.163 2.985 . . . . 0.0 110.5 177.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 63.88 51.11 2.42 Favored 'General case' 0 N--CA 1.518 2.929 0 C-N-CA 127.737 2.415 . . . . 0.0 112.746 -178.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.52 123.34 46.09 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.654 -2.066 . . . . 0.0 109.993 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.563 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.54 -166.99 19.8 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.081 -174.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -171.25 1.91 Allowed 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 119.835 1.817 . . . . 0.0 108.764 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.35 56.83 Favored Pre-proline 0 CA--C 1.593 2.604 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -61.71 -18.91 63.05 Favored 'Trans proline' 1 C--N 1.46 6.43 0 CA-C-N 124.232 2.547 . . . . 0.0 116.875 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.09 -29.99 69.07 Favored 'General case' 0 C--N 1.398 2.685 0 C-N-CA 123.691 0.796 . . . . 0.0 112.093 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.95 -35.32 57.34 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 127.1 2.16 . . . . 0.0 109.698 175.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.75 -50.4 73.96 Favored 'General case' 0 N--CA 1.522 3.163 0 C-N-CA 125.95 1.7 . . . . 0.0 111.705 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm180 -63.16 -43.67 97.66 Favored 'General case' 0 C--N 1.397 2.656 0 C-N-CA 126.638 1.975 . . . . 0.0 111.8 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.51 -44.14 76.34 Favored 'General case' 0 C--N 1.39 2.359 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.88 -42.24 99.69 Favored 'General case' 0 C--N 1.388 2.251 0 C-N-CA 125.727 1.611 . . . . 0.0 114.767 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.45 -51.12 62.47 Favored 'General case' 0 C--N 1.39 2.337 0 CA-C-N 111.973 -2.376 . . . . 0.0 111.627 -175.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.63 -15.63 51.39 Favored 'General case' 0 C--N 1.378 1.838 0 CA-C-N 113.285 -1.779 . . . . 0.0 113.859 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.471 ' HB3' ' CH2' ' A' ' 16' ' ' TRP 0.293 12.4 pt20 -67.95 -39.0 83.49 Favored 'General case' 0 C--N 1.406 3.057 0 CA-C-N 119.437 1.017 . . . . 0.0 111.537 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.44 -22.84 60.1 Favored 'General case' 0 C--N 1.389 2.298 0 C-N-CA 125.068 1.347 . . . . 0.0 111.734 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 t -80.41 -45.19 18.08 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.097 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.38 -45.48 76.12 Favored 'General case' 0 C--N 1.398 2.707 0 C-N-CA 125.364 1.466 . . . . 0.0 113.032 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.06 -38.0 69.54 Favored 'General case' 0 C--N 1.381 1.954 0 C-N-CA 126.821 2.049 . . . . 0.0 112.039 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.53 -27.25 73.92 Favored Glycine 0 C--N 1.392 3.655 0 CA-C-N 119.994 1.27 . . . . 0.0 113.776 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 71.2 mtt180 -73.89 -27.46 61.07 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.397 -1.401 . . . . 0.0 108.807 172.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -64.63 -37.76 94.8 Favored Glycine 1 C--N 1.405 4.371 0 N-CA-C 114.914 0.726 . . . . 0.0 114.914 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.3 m -59.41 -48.43 81.67 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 126.168 1.787 . . . . 0.0 113.169 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 58.9 m -57.91 -55.23 37.64 Favored 'General case' 0 C--N 1.4 2.767 0 C-N-CA 126.654 1.981 . . . . 0.0 113.792 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.27 3.9 mm? -82.16 -12.58 58.07 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 71.03 44.86 53.91 Favored Glycine 0 C--N 1.362 2.006 0 C-N-CA 125.317 1.436 . . . . 0.0 116.654 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.24 134.48 55.18 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 118.834 1.317 . . . . 0.0 108.901 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.86 119.05 13.49 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-O 121.262 0.554 . . . . 0.0 109.623 175.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -41.36 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.539 0 C-N-CA 127.038 2.135 . . . . 0.0 115.164 -177.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -63.65 -45.86 88.25 Favored 'General case' 0 N--CA 1.518 2.951 0 CA-C-N 119.01 0.823 . . . . 0.0 112.932 175.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.502 2.162 0 C-N-CA 124.502 1.121 . . . . 0.0 112.589 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.64 81.02 Favored 'General case' 0 C--N 1.386 2.167 0 C-N-CA 123.999 0.92 . . . . 0.0 111.878 177.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 14' ' ' PHE . 20.4 m -55.87 -53.35 57.78 Favored 'General case' 0 C--N 1.391 2.384 0 O-C-N 124.109 0.88 . . . . 0.0 111.715 176.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.5 -40.35 86.77 Favored 'General case' 0 N--CA 1.517 2.901 0 O-C-N 126.356 2.285 . . . . 0.0 112.584 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.88 -50.44 72.22 Favored 'General case' 0 C--N 1.381 1.937 0 C-N-CA 126.177 1.791 . . . . 0.0 111.516 173.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.27 -25.34 71.04 Favored Glycine 0 C--N 1.39 3.576 0 CA-C-O 117.513 -1.715 . . . . 0.0 115.059 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -48.38 -47.49 37.43 Favored 'General case' 0 N--CA 1.511 2.609 0 CA-C-N 118.199 1.0 . . . . 0.0 111.375 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -66.07 -34.84 78.99 Favored 'General case' 0 C--N 1.393 2.483 0 C-N-CA 125.441 1.496 . . . . 0.0 111.294 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.857 ' O ' HG12 ' A' ' 68' ' ' ILE 0.273 6.3 mt -74.49 -17.53 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.593 2.633 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.064 179.015 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -90.54 -55.16 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.522 3.151 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.59 -71.93 0.09 Allowed 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 112.132 -2.304 . . . . 0.0 111.289 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -52.43 -34.6 49.24 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 117.959 2.578 . . . . 0.0 117.959 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.857 HG12 ' O ' ' A' ' 64' ' ' ILE 0.287 1.2 pt -70.55 -17.03 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.242 0 CA-C-N 122.159 2.254 . . . . 0.0 113.507 176.884 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' HD3' ' B' ' 121' ' ' ARG . 0.2 OUTLIER -90.5 -28.79 18.31 Favored 'General case' 0 C--N 1.389 2.298 0 CA-C-N 118.45 0.568 . . . . 0.0 111.037 -178.064 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 mtmt -81.47 -12.45 58.87 Favored 'General case' 0 N--CA 1.521 3.099 0 CA-C-O 122.672 1.225 . . . . 0.0 112.51 175.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . 0.281 42.7 mt-10 -109.74 -39.53 5.08 Favored 'General case' 0 N--CA 1.517 2.876 0 CA-C-N 111.548 -2.569 . . . . 0.0 113.649 177.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -140.69 115.42 9.59 Favored 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 122.226 2.284 . . . . 0.0 106.915 170.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 118.865 -2.397 . . . . 0.0 112.154 -175.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.4 mtt . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 121.374 0.607 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -128.26 121.84 30.27 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.555 1.142 . . . . 0.0 112.582 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . 0.261 6.5 m 73.66 -60.15 0.54 Allowed 'General case' 0 N--CA 1.532 3.669 0 C-N-CA 126.793 2.037 . . . . 0.0 116.097 176.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.563 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 4.0 m-80 -81.83 -23.55 36.39 Favored 'General case' 0 N--CA 1.506 2.36 0 CA-C-N 120.223 1.374 . . . . 0.0 113.597 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.71 -13.37 37.01 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.793 1.237 . . . . 0.0 108.842 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 47.0 t -89.02 -35.94 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -68.8 -32.35 72.01 Favored 'General case' 0 C--N 1.391 2.382 0 C-N-CA 124.539 1.135 . . . . 0.0 111.538 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -77.91 -13.1 60.0 Favored 'General case' 0 C--N 1.397 2.655 0 C-N-CA 124.057 0.943 . . . . 0.0 111.961 174.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -92.03 -42.23 10.09 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.29 -38.91 88.88 Favored 'General case' 0 N--CA 1.51 2.551 0 C-N-CA 125.377 1.471 . . . . 0.0 112.008 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 t -71.92 -39.36 66.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.885 0 C-N-CA 124.514 1.126 . . . . 0.0 110.729 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.31 -26.93 66.77 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 119.037 0.835 . . . . 0.0 111.761 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.78 -38.79 83.85 Favored 'General case' 0 C--N 1.395 2.548 0 C-N-CA 123.881 0.872 . . . . 0.0 110.043 174.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . 0.533 ' HA ' HG23 ' B' ' 158' ' ' THR . 44.9 t80 -69.9 -50.45 42.1 Favored 'General case' 0 C--N 1.388 2.282 0 C-N-CA 124.763 1.225 . . . . 0.0 110.347 175.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.35 -38.59 91.74 Favored 'General case' 0 C--N 1.379 1.854 0 C-N-CA 124.397 1.079 . . . . 0.0 113.553 -179.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.457 ' CH2' ' HB3' ' B' ' 140' ' ' GLN . 0.9 OUTLIER -70.33 -28.26 65.01 Favored 'General case' 0 CA--C 1.58 2.114 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 173.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -80.82 -21.42 40.85 Favored 'General case' 0 N--CA 1.505 2.322 0 CA-C-N 119.926 1.239 . . . . 0.0 109.019 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 51.3 t -71.13 -39.69 74.22 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.015 0 O-C-N 125.447 1.717 . . . . 0.0 106.711 174.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -75.16 -26.38 59.06 Favored 'General case' 0 CA--C 1.579 2.082 0 C-N-CA 124.206 1.002 . . . . 0.0 112.111 175.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 19.1 tttt -90.06 -5.42 56.59 Favored 'General case' 0 C--N 1.401 2.843 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 178.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . 0.413 ' HD3' HD11 ' A' ' 69' ' ' LEU . 16.1 mtt180 -93.9 -18.99 21.37 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 129.073 2.949 . . . . 0.0 106.269 173.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -88.33 -49.36 7.01 Favored 'General case' 0 CA--C 1.575 1.916 0 C-N-CA 126.314 1.845 . . . . 0.0 110.498 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.23 89.27 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.7 OUTLIER -72.21 -5.56 36.64 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 179.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.87 -8.82 17.48 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 129.15 2.98 . . . . 0.0 110.413 176.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 63.87 50.85 2.49 Favored 'General case' 0 N--CA 1.518 2.932 0 C-N-CA 127.821 2.448 . . . . 0.0 112.741 -178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.22 123.33 45.87 Favored 'General case' 0 C--O 1.255 1.373 0 CA-C-N 112.633 -2.076 . . . . 0.0 110.075 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.542 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.69 -167.32 19.85 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.151 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.33 -171.38 1.93 Allowed 'General case' 0 CA--C 1.555 1.167 0 CA-C-N 119.74 1.77 . . . . 0.0 108.833 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.78 -37.41 57.44 Favored Pre-proline 0 CA--C 1.593 2.623 0 N-CA-C 116.616 2.08 . . . . 0.0 116.616 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.08 -18.03 59.53 Favored 'Trans proline' 1 C--N 1.461 6.462 0 CA-C-N 124.201 2.536 . . . . 0.0 116.884 -178.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -29.82 68.39 Favored 'General case' 0 C--N 1.396 2.607 0 C-N-CA 123.603 0.761 . . . . 0.0 112.05 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.09 -35.31 56.61 Favored 'General case' 0 C--N 1.385 2.139 0 C-N-CA 127.095 2.158 . . . . 0.0 109.651 175.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.72 -50.47 73.71 Favored 'General case' 0 N--CA 1.52 3.072 0 C-N-CA 125.963 1.705 . . . . 0.0 111.785 172.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -63.18 -43.49 98.08 Favored 'General case' 0 C--N 1.399 2.725 0 C-N-CA 126.494 1.918 . . . . 0.0 111.817 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -44.19 76.53 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.84 -42.21 99.65 Favored 'General case' 0 C--N 1.388 2.28 0 C-N-CA 125.8 1.64 . . . . 0.0 114.726 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -65.58 -51.09 62.39 Favored 'General case' 0 C--N 1.389 2.311 0 CA-C-N 111.976 -2.375 . . . . 0.0 111.515 -175.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.81 -12.81 55.11 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 113.34 -1.755 . . . . 0.0 113.978 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . 0.457 ' HB3' ' CH2' ' B' ' 116' ' ' TRP 0.293 12.3 pt20 -69.64 -38.84 77.31 Favored 'General case' 0 C--N 1.406 3.034 0 C-N-CA 119.0 -1.08 . . . . 0.0 111.371 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -73.46 -22.97 60.04 Favored 'General case' 0 C--N 1.389 2.311 0 C-N-CA 125.164 1.386 . . . . 0.0 111.723 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.9 t -80.46 -45.13 18.1 Favored 'General case' 0 C--N 1.395 2.565 0 CA-C-N 112.251 -2.25 . . . . 0.0 110.056 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.31 -45.37 76.68 Favored 'General case' 0 C--N 1.399 2.734 0 C-N-CA 125.269 1.428 . . . . 0.0 113.15 177.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -72.19 -37.92 69.17 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 126.761 2.024 . . . . 0.0 112.116 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -68.51 -27.23 73.92 Favored Glycine 0 C--N 1.393 3.695 0 CA-C-N 119.974 1.261 . . . . 0.0 113.78 175.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -73.81 -27.41 61.11 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.371 -1.415 . . . . 0.0 108.732 172.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.81 94.79 Favored Glycine 1 C--N 1.405 4.402 0 CA-C-O 119.167 -0.796 . . . . 0.0 115.034 173.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 63.1 m -59.17 -48.81 80.24 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 126.218 1.807 . . . . 0.0 112.974 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 32.2 m -53.67 -65.49 0.56 Allowed 'General case' 0 C--N 1.398 2.711 0 C-N-CA 127.491 2.316 . . . . 0.0 112.793 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.266 3.9 mm? -75.3 -13.27 60.41 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 71.4 45.47 47.0 Favored Glycine 0 C--N 1.364 2.092 0 N-CA-C 116.85 1.5 . . . . 0.0 116.85 173.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.67 134.71 54.97 Favored 'General case' 0 C--O 1.258 1.534 0 CA-C-N 118.856 1.328 . . . . 0.0 109.017 -177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.09 118.88 13.48 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.343 0.592 . . . . 0.0 109.545 175.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -41.41 48.49 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.588 0 C-N-CA 127.07 2.148 . . . . 0.0 115.186 -177.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.51 -45.86 88.72 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-N 118.95 0.795 . . . . 0.0 112.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -73.91 -36.62 64.74 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.353 1.061 . . . . 0.0 112.625 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.69 81.18 Favored 'General case' 0 C--N 1.385 2.128 0 C-N-CA 124.012 0.925 . . . . 0.0 111.887 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 114' ' ' PHE . 20.4 m -55.82 -53.29 58.55 Favored 'General case' 0 C--N 1.39 2.368 0 O-C-N 124.191 0.932 . . . . 0.0 111.768 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -59.47 -40.24 86.26 Favored 'General case' 0 N--CA 1.518 2.966 0 O-C-N 126.317 2.261 . . . . 0.0 112.43 177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.54 71.65 Favored 'General case' 0 C--N 1.379 1.883 0 C-N-CA 126.214 1.806 . . . . 0.0 111.565 173.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -74.12 -25.48 71.04 Favored Glycine 0 C--N 1.392 3.686 0 CA-C-O 117.645 -1.642 . . . . 0.0 115.135 175.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -47.15 33.28 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.033 0.917 . . . . 0.0 111.36 169.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -66.47 -34.88 78.91 Favored 'General case' 0 C--N 1.393 2.461 0 C-N-CA 125.292 1.437 . . . . 0.0 111.196 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . 0.868 ' O ' HG12 ' B' ' 168' ' ' ILE . 4.5 mt -77.5 -6.44 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.6 2.877 0 O-C-N 124.492 1.12 . . . . 0.0 111.93 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 74.5 t -101.13 -53.78 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.015 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -55.15 -79.65 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.843 0 CA-C-N 112.211 -2.268 . . . . 0.0 109.664 177.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -46.79 -34.04 4.93 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . 0.868 HG12 ' O ' ' B' ' 164' ' ' ILE . 1.2 pt -74.99 -7.91 10.8 Favored 'Isoleucine or valine' 0 C--N 1.405 2.979 0 CA-C-N 122.689 2.495 . . . . 0.0 113.059 175.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.423 HD11 ' HD3' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -106.18 5.76 30.25 Favored 'General case' 0 C--N 1.396 2.621 0 CA-C-O 121.567 0.698 . . . . 0.0 111.835 -178.264 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -119.08 -9.86 9.93 Favored 'General case' 0 N--CA 1.515 2.806 0 CA-C-O 123.812 1.768 . . . . 0.0 108.72 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . 0.333 40.7 mt-10 -111.42 -57.74 2.21 Favored 'General case' 0 N--CA 1.505 2.298 0 CA-C-N 109.523 -3.489 . . . . 0.0 111.456 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -125.57 115.05 19.56 Favored 'General case' 0 N--CA 1.509 2.481 0 CA-C-N 122.897 2.59 . . . . 0.0 108.175 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 118.76 -2.462 . . . . 0.0 111.957 -175.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.41 110.51 21.66 Favored 'General case' 0 C--N 1.375 1.712 0 CA-C-O 122.895 1.331 . . . . 0.0 112.846 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.0 m -102.25 -46.21 4.89 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 112.251 -2.249 . . . . 0.0 113.715 177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.48 ' O ' ' HA2' ' B' ' 128' ' ' GLY . 3.4 m120 -85.79 -20.16 29.64 Favored 'General case' 0 N--CA 1.507 2.401 0 CA-C-N 120.099 1.318 . . . . 0.0 113.834 -178.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 m -87.15 -25.64 23.99 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.445 1.098 . . . . 0.0 109.155 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 t -83.16 -34.12 10.85 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.4 m -66.82 -36.03 81.41 Favored 'General case' 0 C--N 1.389 2.285 0 C-N-CA 124.19 0.996 . . . . 0.0 112.269 175.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.8 m -75.61 -14.79 60.39 Favored 'General case' 0 C--N 1.394 2.519 0 C-N-CA 124.063 0.945 . . . . 0.0 111.981 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -88.67 -41.52 12.55 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-O 118.502 -0.761 . . . . 0.0 108.988 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -65.88 -39.08 90.34 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 125.051 1.34 . . . . 0.0 111.121 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.15 -39.19 73.49 Favored 'Isoleucine or valine' 0 C--N 1.377 1.784 0 C-N-CA 125.296 1.438 . . . . 0.0 110.723 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.72 -28.67 67.85 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 119.097 0.862 . . . . 0.0 112.013 173.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.3 -39.49 85.96 Favored 'General case' 0 C--N 1.391 2.378 0 C-N-CA 124.323 1.049 . . . . 0.0 110.605 175.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -69.5 -48.83 59.32 Favored 'General case' 0 C--N 1.386 2.166 0 C-N-CA 124.795 1.238 . . . . 0.0 109.726 175.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.51 -40.05 96.05 Favored 'General case' 0 C--N 1.382 1.989 0 C-N-CA 124.413 1.085 . . . . 0.0 113.848 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.89 -28.73 67.76 Favored 'General case' 0 CA--C 1.584 2.264 0 CA-C-N 119.565 1.075 . . . . 0.0 111.921 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -78.87 -25.23 43.93 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 119.738 1.154 . . . . 0.0 108.861 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.55 -39.58 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 125.432 1.708 . . . . 0.0 106.675 174.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.6 -28.8 59.02 Favored 'General case' 0 CA--C 1.585 2.292 0 C-N-CA 124.218 1.007 . . . . 0.0 112.201 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.3 tttt -85.48 -12.98 50.51 Favored 'General case' 0 C--N 1.404 2.954 0 C-N-CA 124.299 1.04 . . . . 0.0 113.057 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -89.03 -23.03 22.68 Favored 'General case' 0 N--CA 1.511 2.618 0 C-N-CA 128.563 2.745 . . . . 0.0 107.064 174.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.43 -49.52 7.56 Favored 'General case' 0 CA--C 1.583 2.242 0 C-N-CA 127.642 2.377 . . . . 0.0 111.098 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.27 -41.76 96.78 Favored 'General case' 0 N--CA 1.51 2.564 0 C-N-CA 124.821 1.248 . . . . 0.0 113.312 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -71.24 -7.29 45.89 Favored 'General case' 0 N--CA 1.516 2.87 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 177.807 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -103.95 -11.52 17.39 Favored 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 128.688 2.795 . . . . 0.0 109.785 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.286 9.3 mt-10 65.74 58.53 0.78 Allowed 'General case' 0 N--CA 1.517 2.913 0 C-N-CA 128.065 2.546 . . . . 0.0 112.863 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.35 121.66 45.66 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 112.527 -2.124 . . . . 0.0 110.108 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' ASN . . . 100.83 -166.0 19.09 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 113.345 -1.752 . . . . 0.0 109.396 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.37 -172.93 2.22 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 119.495 1.647 . . . . 0.0 109.145 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.47 -37.88 62.31 Favored Pre-proline 0 CA--C 1.592 2.585 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -60.89 -17.52 51.47 Favored 'Trans proline' 1 C--N 1.46 6.419 0 CA-C-N 124.088 2.496 . . . . 0.0 117.132 -178.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -69.14 -26.31 64.82 Favored 'General case' 0 C--N 1.395 2.573 0 C-N-CA 123.228 0.611 . . . . 0.0 112.158 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.75 -35.16 45.05 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.935 2.094 . . . . 0.0 109.097 174.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.98 -49.91 75.81 Favored 'General case' 0 N--CA 1.521 3.117 0 C-N-CA 125.946 1.698 . . . . 0.0 111.528 172.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.48 -44.46 94.35 Favored 'General case' 0 C--N 1.399 2.736 0 C-N-CA 126.994 2.118 . . . . 0.0 111.7 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.34 -44.03 75.54 Favored 'General case' 0 C--N 1.396 2.603 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 176.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.65 -42.67 98.09 Favored 'General case' 0 C--N 1.399 2.745 0 C-N-CA 125.981 1.712 . . . . 0.0 115.215 -177.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.54 -51.89 56.53 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 112.215 -2.266 . . . . 0.0 111.518 -175.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.92 -17.81 45.85 Favored 'General case' 0 C--N 1.375 1.692 0 CA-C-N 113.064 -1.88 . . . . 0.0 113.629 -179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . 0.287 11.0 pt20 -68.57 -38.79 81.03 Favored 'General case' 0 C--N 1.393 2.499 0 CA-C-N 119.21 0.914 . . . . 0.0 111.914 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.25 -22.9 60.31 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 125.711 1.604 . . . . 0.0 111.91 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 t -79.86 -43.94 21.39 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 112.076 -2.329 . . . . 0.0 109.845 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -46.1 73.64 Favored 'General case' 0 C--N 1.39 2.367 0 C-N-CA 125.385 1.474 . . . . 0.0 112.282 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.73 -37.79 70.56 Favored 'General case' 0 C--N 1.382 2.022 0 C-N-CA 126.722 2.009 . . . . 0.0 111.844 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -66.59 -27.83 73.41 Favored Glycine 0 C--N 1.392 3.656 0 CA-C-N 120.13 1.332 . . . . 0.0 113.81 174.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -72.47 -27.78 62.51 Favored 'General case' 0 C--N 1.385 2.113 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.9 -38.35 95.97 Favored Glycine 1 C--N 1.4 4.12 0 CA-C-O 119.068 -0.851 . . . . 0.0 115.1 173.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.4 m -59.64 -49.84 76.19 Favored 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.863 1.665 . . . . 0.0 113.624 178.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -60.59 3.31 Favored 'General case' 0 N--CA 1.514 2.742 0 C-N-CA 126.574 1.95 . . . . 0.0 115.137 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.267 1.2 mt -78.03 -12.4 59.98 Favored 'General case' 0 N--CA 1.514 2.767 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 177.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.91 47.3 19.92 Favored Glycine 0 C--N 1.363 2.071 0 N-CA-C 117.848 1.899 . . . . 0.0 117.848 172.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -124.24 136.4 54.12 Favored 'General case' 0 C--O 1.258 1.525 0 CA-C-N 119.684 1.742 . . . . 0.0 109.697 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.89 121.14 15.97 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.408 0.623 . . . . 0.0 109.915 174.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.544 ' O ' HG23 ' A' ' 58' ' ' THR 0.252 0.8 OUTLIER -53.83 -47.6 63.16 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.311 0 C-N-CA 126.688 1.995 . . . . 0.0 114.652 -178.345 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -62.04 -45.72 92.31 Favored 'General case' 0 N--CA 1.523 3.204 0 CA-C-N 119.44 1.018 . . . . 0.0 113.273 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t -67.56 -31.3 71.28 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 123.264 0.626 . . . . 0.0 110.559 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.21 64.59 Favored 'General case' 0 C--N 1.379 1.884 0 O-C-N 124.607 1.192 . . . . 0.0 112.127 175.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 54' ' ' ILE . 43.6 p -65.41 -19.02 65.76 Favored 'General case' 0 N--CA 1.526 3.373 0 CA-C-O 122.345 1.069 . . . . 0.0 112.503 176.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -99.17 -43.16 6.74 Favored 'General case' 0 C--N 1.398 2.716 0 CA-C-N 111.324 -2.671 . . . . 0.0 110.743 -174.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.0 83.16 Favored 'General case' 0 C--N 1.381 1.96 0 C-N-CA 126.891 2.076 . . . . 0.0 110.635 174.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.89 -26.45 66.9 Favored Glycine 0 C--N 1.388 3.471 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.723 173.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -49.47 -47.67 48.23 Favored 'General case' 0 N--CA 1.515 2.788 0 CA-C-N 118.231 1.015 . . . . 0.0 111.693 169.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.74 -35.99 79.73 Favored 'General case' 0 C--N 1.384 2.087 0 C-N-CA 125.511 1.524 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.546 ' O ' ' HB ' ' A' ' 68' ' ' ILE 0.262 39.3 mt -69.06 -49.29 63.88 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.264 0 O-C-N 125.148 1.53 . . . . 0.0 110.118 -179.868 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.43 -50.02 81.42 Favored 'Isoleucine or valine' 1 N--CA 1.539 4.013 0 CA-C-N 120.445 1.475 . . . . 0.0 112.977 175.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -57.49 -73.58 0.07 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 125.923 2.015 . . . . 0.0 110.004 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -52.62 -38.38 60.08 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 173.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 64' ' ' ILE 0.289 0.1 OUTLIER -71.95 -17.58 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 CA-C-N 122.688 2.494 . . . . 0.0 115.357 -179.557 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 mp -90.77 -26.51 19.44 Favored 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -81.85 -6.76 59.36 Favored 'General case' 0 CA--C 1.606 3.123 0 CA-C-O 123.382 1.563 . . . . 0.0 111.615 174.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.89 12.19 31.14 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 110.614 -2.993 . . . . 0.0 114.009 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -97.44 -24.56 15.55 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -171.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--N 1.379 1.86 0 CA-C-O 118.12 -0.943 . . . . 0.0 112.022 -177.818 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt . . . . . 0 N--CA 1.5 2.053 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.22 110.24 21.39 Favored 'General case' 0 C--N 1.374 1.665 0 CA-C-O 122.906 1.336 . . . . 0.0 112.728 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' SER . . . . . . . . . . . . . 31.6 m -101.99 -45.81 5.07 Favored 'General case' 0 N--CA 1.494 1.745 0 CA-C-N 112.181 -2.281 . . . . 0.0 113.615 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ASN . . . . . 0.498 ' O ' ' HA2' ' A' ' 28' ' ' GLY . 3.4 m120 -86.31 -19.99 29.03 Favored 'General case' 0 N--CA 1.506 2.367 0 CA-C-N 120.098 1.317 . . . . 0.0 113.669 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.8 m -87.35 -25.65 23.76 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.371 1.068 . . . . 0.0 109.088 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 10.3 t -82.97 -34.11 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 72.8 m -66.95 -35.51 80.13 Favored 'General case' 0 C--N 1.388 2.266 0 C-N-CA 124.089 0.956 . . . . 0.0 112.227 175.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' SER . . . . . . . . . . . . . 5.7 m -77.78 -9.93 59.28 Favored 'General case' 0 C--N 1.396 2.601 0 CA-C-N 119.375 0.989 . . . . 0.0 112.171 175.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -92.38 -41.39 10.36 Favored 'General case' 0 C--N 1.375 1.674 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -66.02 -39.25 90.07 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 125.08 1.352 . . . . 0.0 110.954 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.31 -39.3 72.18 Favored 'Isoleucine or valine' 0 C--N 1.377 1.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.6 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -28.69 68.06 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 119.148 0.886 . . . . 0.0 112.024 173.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 91.7 m -67.38 -39.43 85.62 Favored 'General case' 0 C--N 1.391 2.376 0 C-N-CA 124.32 1.048 . . . . 0.0 110.675 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -69.63 -48.69 59.08 Favored 'General case' 0 C--N 1.386 2.153 0 C-N-CA 124.81 1.244 . . . . 0.0 109.618 175.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.46 -40.01 95.99 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 124.368 1.067 . . . . 0.0 113.753 -178.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -67.94 -28.78 67.77 Favored 'General case' 0 CA--C 1.584 2.259 0 CA-C-N 119.554 1.07 . . . . 0.0 111.94 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -78.86 -25.43 43.99 Favored 'General case' 0 C--N 1.391 2.39 0 CA-C-N 119.736 1.153 . . . . 0.0 108.946 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 61.7 t -71.37 -39.54 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 125.533 1.771 . . . . 0.0 106.522 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -75.57 -28.36 58.95 Favored 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 124.018 0.927 . . . . 0.0 112.138 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' B' ' 124' ' ' ASP . 7.5 tttt -88.4 -6.59 57.59 Favored 'General case' 0 C--N 1.407 3.09 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -94.3 -22.22 18.5 Favored 'General case' 0 N--CA 1.509 2.513 0 C-N-CA 129.15 2.98 . . . . 0.0 106.684 173.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -87.76 -49.15 7.31 Favored 'General case' 0 CA--C 1.582 2.205 0 C-N-CA 127.418 2.287 . . . . 0.0 110.77 174.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.9 96.21 Favored 'General case' 0 N--CA 1.509 2.524 0 C-N-CA 124.703 1.201 . . . . 0.0 113.298 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 120' ' ' LYS . 0.6 OUTLIER -71.45 -6.82 43.24 Favored 'General case' 0 N--CA 1.515 2.791 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 177.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -104.3 -11.43 17.18 Favored 'General case' 0 CA--C 1.57 1.717 0 C-N-CA 128.674 2.79 . . . . 0.0 109.832 177.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . 0.283 9.4 mt-10 65.59 58.98 0.78 Allowed 'General case' 0 N--CA 1.518 2.947 0 C-N-CA 128.051 2.541 . . . . 0.0 112.84 -178.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 121.64 45.67 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 112.455 -2.157 . . . . 0.0 110.116 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 4' ' ' ASN . . . 100.74 -165.4 18.94 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-N 113.285 -1.78 . . . . 0.0 109.33 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.52 -173.11 2.25 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 119.422 1.611 . . . . 0.0 109.162 176.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.67 -37.81 61.76 Favored Pre-proline 0 CA--C 1.593 2.611 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -61.58 -15.62 42.74 Favored 'Trans proline' 1 C--N 1.46 6.439 0 CA-C-N 124.205 2.537 . . . . 0.0 117.184 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -26.12 63.58 Favored 'General case' 0 C--N 1.395 2.557 0 C-N-CA 123.227 0.611 . . . . 0.0 111.992 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.8 -35.15 44.73 Favored 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 127.03 2.132 . . . . 0.0 109.152 174.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -49.99 75.5 Favored 'General case' 0 N--CA 1.521 3.101 0 C-N-CA 125.874 1.67 . . . . 0.0 111.63 172.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -63.58 -44.38 94.24 Favored 'General case' 0 C--N 1.398 2.676 0 C-N-CA 127.028 2.131 . . . . 0.0 111.65 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -44.12 75.71 Favored 'General case' 0 C--N 1.394 2.526 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.54 -42.74 98.38 Favored 'General case' 0 C--N 1.398 2.711 0 C-N-CA 126.05 1.74 . . . . 0.0 115.185 -177.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 13.7 mtm180 -65.51 -51.9 56.65 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.143 -2.298 . . . . 0.0 111.585 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.1 -17.51 46.25 Favored 'General case' 0 C--N 1.375 1.683 0 CA-C-N 113.045 -1.888 . . . . 0.0 113.687 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . 0.285 10.9 pt20 -68.73 -38.68 80.36 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.936 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -73.31 -22.91 60.23 Favored 'General case' 0 C--N 1.401 2.837 0 C-N-CA 125.817 1.647 . . . . 0.0 111.924 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' SER . . . . . . . . . . . . . 1.6 t -79.9 -44.12 20.97 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-N 112.072 -2.331 . . . . 0.0 109.834 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -46.11 74.21 Favored 'General case' 0 C--N 1.391 2.388 0 C-N-CA 125.431 1.492 . . . . 0.0 112.34 177.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -71.64 -37.78 70.8 Favored 'General case' 0 N--CA 1.5 2.057 0 C-N-CA 126.685 1.994 . . . . 0.0 111.894 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.74 -27.72 73.42 Favored Glycine 0 C--N 1.392 3.689 0 CA-C-N 120.175 1.352 . . . . 0.0 113.782 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -72.38 -27.68 62.53 Favored 'General case' 0 C--N 1.386 2.163 0 C-N-CA 125.654 1.582 . . . . 0.0 108.829 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . -64.19 -38.34 95.8 Favored Glycine 1 C--N 1.401 4.173 0 N-CA-C 115.181 0.832 . . . . 0.0 115.181 173.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' SER . . . . . . . . . . . . . 67.4 m -59.6 -49.65 76.94 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.913 1.685 . . . . 0.0 113.534 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.23 -70.45 0.09 Allowed 'General case' 0 C--N 1.397 2.644 0 C-N-CA 127.336 2.254 . . . . 0.0 114.102 176.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . 0.256 1.2 mt -70.94 -14.28 62.31 Favored 'General case' 0 N--CA 1.514 2.754 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 74.57 49.65 10.83 Favored Glycine 0 C--N 1.366 2.239 0 N-CA-C 117.902 1.921 . . . . 0.0 117.902 172.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.57 136.58 53.45 Favored 'General case' 0 C--O 1.258 1.552 0 CA-C-N 119.634 1.717 . . . . 0.0 109.631 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.95 121.09 15.9 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 121.463 0.649 . . . . 0.0 109.86 174.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' ILE . . . . . 0.525 ' O ' HG23 ' B' ' 158' ' ' THR 0.253 0.8 OUTLIER -53.52 -47.91 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.38 0 C-N-CA 126.65 1.98 . . . . 0.0 114.614 -178.352 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.81 -45.96 91.57 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 119.389 0.995 . . . . 0.0 113.309 177.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 t -67.21 -31.21 71.43 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.334 0.654 . . . . 0.0 110.356 176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' ALA . . . . . . . . . . . . . . . -73.51 -30.24 62.99 Favored 'General case' 0 C--N 1.379 1.876 0 O-C-N 124.551 1.157 . . . . 0.0 112.063 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.525 HG23 ' O ' ' B' ' 154' ' ' ILE . 43.2 p -67.37 -11.72 58.4 Favored 'General case' 0 N--CA 1.526 3.352 0 CA-C-N 119.578 1.081 . . . . 0.0 113.192 176.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -109.22 -41.24 4.71 Favored 'General case' 0 N--CA 1.509 2.48 0 CA-C-N 112.061 -2.336 . . . . 0.0 109.951 -173.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.82 78.65 Favored 'General case' 0 C--N 1.379 1.852 0 C-N-CA 126.39 1.876 . . . . 0.0 110.13 172.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . -73.92 -27.55 66.5 Favored Glycine 0 C--N 1.392 3.684 0 CA-C-O 117.56 -1.689 . . . . 0.0 114.689 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -47.99 -46.23 32.53 Favored 'General case' 0 N--CA 1.512 2.671 0 CA-C-N 118.403 1.102 . . . . 0.0 111.492 169.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' B' ' 167' ' ' ARG . 55.5 mt-30 -68.81 -34.72 75.99 Favored 'General case' 0 CA--C 1.581 2.164 0 C-N-CA 125.305 1.442 . . . . 0.0 112.033 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' ILE . . . . . . . . . . . . . 12.9 mt -78.58 -9.85 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.193 0 C-N-CA 125.032 1.333 . . . . 0.0 112.977 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 54.5 t -97.73 -50.43 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.524 3.26 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.94 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.549 0 O-C-N 126.99 2.681 . . . . 0.0 107.972 177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 163' ' ' GLN . 6.9 mtm180 -46.9 -38.62 10.75 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 117.853 2.538 . . . . 0.0 117.853 174.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' ILE . . . . . . . . . . . . 0.256 0.1 OUTLIER -73.99 -11.21 14.44 Favored 'Isoleucine or valine' 0 C--N 1.414 3.386 0 CA-C-N 123.761 2.982 . . . . 0.0 115.452 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.6 mp -96.32 -25.08 15.89 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -83.05 -4.82 58.75 Favored 'General case' 0 CA--C 1.605 3.094 0 CA-C-O 123.342 1.544 . . . . 0.0 111.465 173.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.24 11.08 37.68 Favored 'General case' 0 N--CA 1.509 2.523 0 CA-C-N 110.743 -2.935 . . . . 0.0 114.053 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -96.82 -24.36 15.94 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -171.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.383 2.031 0 C-N-CA 124.082 0.953 . . . . 0.0 112.066 -177.837 . . . . . . . . 0 0 . 1 stop_ save_