data_2kbz_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 2kbz _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.663 ' H ' HD12 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.597 ' HZ3' ' HG ' ' A' ' 71' ' ' CYS 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.597 ' HG ' ' HZ3' ' A' ' 68' ' ' LYS . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.475 ' HA ' HG21 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.475 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.497 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.422 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.422 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.416 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.434 -1.259 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HD2' ' HB2' ' A' ' 99' ' ' TYR . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.415 HG23 ' HB2' ' A' ' 128' ' ' LYS 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.415 ' HB2' HG23 ' A' ' 125' ' ' ILE 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 C--O 1.222 -0.376 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.443 ' HA ' HG22 ' A' ' 92' ' ' VAL . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.461 ' HB3' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 115.138 1.532 . . . . 0.0 115.138 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.482 HD21 ' N ' ' A' ' 130' ' ' ASN . 1.0 OUTLIER -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 . . . . . 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.458 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.458 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.42 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HA ' ' HE3' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER . . . . . 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.42 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.433 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.406 ' HA ' ' HE2' ' A' ' 68' ' ' LYS 0.477 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--O 1.222 -0.373 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' CD2' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.442 ' CD2' ' CE1' ' A' ' 52' ' ' HIS . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.65 ' HZ1' HG12 ' A' ' 88' ' ' VAL 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.65 HG12 ' HZ1' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.433 ' HB ' ' HA ' ' A' ' 89' ' ' LEU . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 . . . . . 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 . . . . . 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.49 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.49 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 41.6 ttp180 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.422 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.404 HG11 HG22 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.404 HG22 HG11 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.447 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.289 2.4 t-20 . . . . . 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.431 HD21 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.806 0 N-CA-C 116.785 2.143 . . . . 0.0 116.785 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.431 ' N ' HD21 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.553 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.553 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.447 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.43 ' HA ' HG23 ' A' ' 64' ' ' VAL 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 61' ' ' PRO 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.563 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.442 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 1.5 p30 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.429 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' HA ' HG21 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.412 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.493 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.493 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.563 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.442 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 . . . . . 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER . . . . . 0 C--O 1.214 -0.792 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.417 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 117' ' ' PHE . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.501 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.424 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.501 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 . . . . . 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp . . . . . 0 C--O 1.22 -0.461 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.434 ' CG2' ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.434 ' H ' ' CG2' ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 4 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.464 ' HZ2' ' HB3' ' A' ' 133' ' ' ARG 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.419 ' HA ' HG21 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.419 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 7.5 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 . . . . . 0 CA--C 1.505 -0.781 0 CA-C-O 122.995 1.379 . . . . 0.0 108.189 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.435 ' CD1' ' N ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.4 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.535 ' CD1' ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.464 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 5.1 tmm_? . . . . . 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HE2' HD22 ' A' ' 73' ' ' ASN 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.498 HD22 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.416 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.416 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.425 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.409 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.731 0 N-CA-C 116.404 2.001 . . . . 0.0 116.404 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.409 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.464 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.478 ' HZ2' ' HG3' ' A' ' 133' ' ' ARG 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HB ' ' HB ' ' A' ' 60' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 . . . . . 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.228 0 N-CA-C 121.082 3.734 . . . . 0.0 121.082 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.416 ' CD2' ' HB2' ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.435 ' HB2' ' H ' ' A' ' 133' ' ' ARG . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.478 ' HG3' ' HZ2' ' A' ' 68' ' ' LYS 0.332 9.3 ptm180 . . . . . 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.456 HG23 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.456 ' HB ' HG23 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.462 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.465 2.3 t-20 . . . . . 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.462 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.418 ' CD2' ' N ' ' A' ' 133' ' ' ARG . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 . . . . . 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.421 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.428 ' HA ' HG21 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.428 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER . . . . . 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.513 -0.47 0 CA-C-O 122.675 1.226 . . . . 0.0 107.788 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.483 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.483 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HB2' ' HZ1' ' A' ' 127' ' ' LYS . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.498 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.609 ' HZ1' ' HA ' ' A' ' 130' ' ' ASN 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.45 ' HA ' HG21 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.463 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 . . . . . 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.192 1 N-CA-C 123.374 4.583 . . . . 0.0 123.374 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.463 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.471 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.471 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.609 ' HA ' ' HZ1' ' A' ' 68' ' ' LYS . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.501 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.501 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 . . . . . 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.401 ' HE2' ' CE2' ' A' ' 99' ' ' TYR . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.44 ' H ' HG11 ' A' ' 60' ' ' VAL 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.418 ' HA ' HG12 ' A' ' 64' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HZ2' ' HB3' ' A' ' 75' ' ' PHE . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.415 ' HB3' ' HG2' ' A' ' 68' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.565 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.438 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.412 ' CE2' ' HD2' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? . . . . . 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 4 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.486 HG13 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 3 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' HG13 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.511 -0.543 0 CA-C-O 123.812 1.768 . . . . 0.0 114.708 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.412 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.378 0 N-CA-C 112.816 0.672 . . . . 0.0 112.816 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.406 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 4 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.458 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.458 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.409 ' O ' ' CD2' ' A' ' 132' ' ' TYR . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 . . . . . 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm . . . . . 0 CA--C 1.511 -0.533 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.417 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 3 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 89' ' ' LEU . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.434 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 . . . . . 0 CA--C 1.507 -0.695 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.44 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.413 ' HA ' HG11 ' A' ' 64' ' ' VAL . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.413 HG11 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.438 HG12 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.562 ' CD1' HG21 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 . . . . . 0 CA--C 1.502 -0.868 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.562 HG21 ' CD1' ' A' ' 99' ' ' TYR 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.404 ' HB2' HG12 ' A' ' 125' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 122' ' ' PRO 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.438 ' CG ' HG12 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 3 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 59' ' ' MET 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.465 ' HE2' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.408 HG23 ' HH ' ' A' ' 99' ' ' TYR 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.452 ' HA ' HG21 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.465 ' CE2' ' HE2' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.0 m120 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . 0.499 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . 0.534 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . 0.514 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 6.4 tmm_? . . . . . 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 . . . . . 0 N--CA 1.44 -0.928 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.287 84.3 mtm180 87.57 -19.67 0.23 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 129.659 3.183 . . . . 0.0 113.033 -178.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 t -63.11 -38.97 83.48 Favored 'Isoleucine or valine' 0 C--N 1.368 1.38 0 C-N-CA 129.009 2.924 . . . . 0.0 112.894 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -63.44 -27.55 69.36 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 129.91 3.284 . . . . 0.0 113.917 174.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.663 ' H ' HD12 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.597 ' HZ3' ' HG ' ' A' ' 71' ' ' CYS 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.597 ' HG ' ' HZ3' ' A' ' 68' ' ' LYS . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.475 ' HA ' HG21 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.475 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.497 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.422 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -95.1 -63.34 1.18 Allowed 'General case' 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.25 12.22 33.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.855 3.28 . . . . 0.0 119.855 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -80.23 -17.08 74.96 Favored Glycine 0 C--N 1.357 1.707 0 O-C-N 119.331 -2.106 . . . . 0.0 110.3 161.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.46 -56.2 2.24 Favored 'General case' 0 CA--C 1.493 -1.235 0 C-N-CA 129.096 2.958 . . . . 0.0 117.026 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 47.5 p -91.78 12.39 21.55 Favored 'General case' 0 C--N 1.355 0.827 0 CA-C-O 123.598 1.666 . . . . 0.0 111.028 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -64.33 3.93 Favored Glycine 0 C--N 1.35 1.317 1 C-N-CA 135.135 6.112 . . . . 0.0 119.939 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.259 53.2 ttt180 87.15 -10.87 0.58 Allowed 'General case' 0 C--N 1.36 1.064 0 C-N-CA 129.188 2.995 . . . . 0.0 115.561 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.4 m -110.63 31.31 6.07 Favored 'General case' 0 C--N 1.362 1.116 0 O-C-N 119.908 -1.745 . . . . 0.0 113.999 -177.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.275 12.9 tpt 80.52 145.99 0.08 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.69 2.796 . . . . 0.0 117.476 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -87.83 20.09 3.21 Favored 'General case' 0 C--N 1.368 1.381 0 C-N-CA 129.259 3.024 . . . . 0.0 116.487 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 27.7 m 165.69 115.74 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.901 3.28 . . . . 0.0 104.012 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 9.5 p -156.81 -176.63 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 18.1 m -74.16 61.31 0.84 Allowed 'General case' 0 C--N 1.368 1.409 0 C-N-CA 129.549 3.14 . . . . 0.0 109.925 172.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.357 22.9 m-85 -22.53 137.07 0.01 OUTLIER 'General case' 0 C--N 1.357 0.909 2 N-CA-C 127.217 6.006 . . . . 0.0 127.217 -166.396 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -5.52 46.23 Favored 'General case' 0 C--N 1.36 1.039 1 C-N-CA 134.361 5.064 . . . . 0.0 116.437 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.422 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -148.52 153.7 38.78 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 5.2 mmtp 68.36 -55.66 0.51 Allowed 'General case' 0 C--N 1.354 0.788 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . 0.347 1.8 mpt? 68.73 -30.5 0.18 Allowed 'General case' 0 C--N 1.359 1.021 0 C-N-CA 131.401 3.88 . . . . 0.0 116.18 177.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -167.28 -176.11 3.16 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 127.754 2.422 . . . . 0.0 105.161 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 174.624 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.5 tp60 . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 83.8 107.84 0.06 Allowed 'General case' 0 C--N 1.363 1.185 0 C-N-CA 129.654 3.182 . . . . 0.0 110.811 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.63 -44.93 59.29 Favored 'Isoleucine or valine' 0 C--N 1.369 1.454 0 C-N-CA 128.96 2.904 . . . . 0.0 116.959 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER -68.66 -26.13 65.16 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.083 2.553 . . . . 0.0 115.609 172.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.14 5.66 24.16 Favored 'General case' 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.17 12.11 34.24 Favored 'General case' 0 C--N 1.373 1.596 0 CA-C-N 122.036 2.198 . . . . 0.0 114.687 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.93 -11.89 69.44 Favored Glycine 0 C--N 1.36 1.903 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 158.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.372 2.5 pp -117.81 -56.62 2.18 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 117.776 2.51 . . . . 0.0 117.776 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 m -92.28 38.71 1.01 Allowed 'General case' 0 C--N 1.36 1.054 0 C-N-CA 128.678 2.791 . . . . 0.0 107.048 177.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.74 -179.73 30.56 Favored Glycine 0 C--N 1.355 1.61 0 C-N-CA 126.552 2.025 . . . . 0.0 113.646 -161.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -165.51 176.86 7.83 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 119.624 -2.103 . . . . 0.0 105.964 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -72.38 70.98 0.9 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.452 2.301 . . . . 0.0 114.057 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.254 26.4 mmt 104.87 -77.12 0.0 OUTLIER 'General case' 0 C--N 1.357 0.935 0 C-N-CA 131.537 3.935 . . . . 0.0 109.824 -178.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.254 34.3 t70 98.03 71.98 0.0 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 128.699 2.8 . . . . 0.0 107.543 -169.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.324 75.3 m 75.05 -48.93 0.65 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.788 2.835 . . . . 0.0 115.434 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.492 0.5 OUTLIER 106.63 -39.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 130.765 3.626 . . . . 0.0 110.786 178.409 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.1 m -85.2 -11.38 55.08 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 125.686 1.594 . . . . 0.0 112.1 170.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 54.78 -98.82 0.09 Allowed 'General case' 0 C--N 1.372 1.545 0 C-N-CA 130.412 3.485 . . . . 0.0 118.562 175.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.416 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.5 OUTLIER -179.38 22.36 0.0 OUTLIER 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.424 -1.716 . . . . 0.0 108.658 -164.453 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HD2' ' HB2' ' A' ' 99' ' ' TYR . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.415 HG23 ' HB2' ' A' ' 128' ' ' LYS 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.415 ' HB2' HG23 ' A' ' 125' ' ' ILE 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 74.87 -69.12 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -171.72 35.18 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 174.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.0 ppp? -68.09 -19.24 64.84 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.102 2.26 . . . . 0.0 117.102 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -120.89 115.43 23.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 126.784 2.034 . . . . 0.0 108.178 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 . . . . . 0 C--N 1.359 1.018 0 C-N-CA 125.274 1.43 . . . . 0.0 112.265 -178.622 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.947 0 CA-C-O 121.955 0.883 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -115.36 125.04 52.72 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 126.301 1.84 . . . . 0.0 106.282 177.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.25 27.6 m -61.92 -34.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 C-N-CA 128.244 2.618 . . . . 0.0 115.551 -178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -67.98 -28.18 67.22 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.791 2.436 . . . . 0.0 113.077 172.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.443 ' HA ' HG22 ' A' ' 92' ' ' VAL . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.461 ' HB3' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 162.77 60.5 0.0 OUTLIER 'General case' 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.98 26.5 9.18 Favored 'General case' 0 C--N 1.37 1.464 0 O-C-N 119.606 -1.934 . . . . 0.0 112.353 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 101.65 20.75 12.42 Favored Glycine 0 C--N 1.365 2.144 0 O-C-N 120.964 -1.085 . . . . 0.0 113.904 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.424 ' HG ' ' N ' ' A' ' 106' ' ' THR . 2.4 pt? -88.43 -59.24 2.29 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.364 1.865 . . . . 0.0 112.14 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.424 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 4.1 m -86.73 7.55 26.28 Favored 'General case' 0 C--N 1.381 1.953 0 C-N-CA 129.209 3.003 . . . . 0.0 108.932 176.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.97 -5.78 52.95 Favored Glycine 0 N--CA 1.416 -2.644 1 C-N-CA 130.806 4.05 . . . . 0.0 113.683 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.9 ttt-85 -168.23 -39.62 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 CA-C-N 120.318 2.059 . . . . 0.0 112.186 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.5 m -112.32 -176.29 2.88 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 125.124 1.37 . . . . 0.0 107.862 -178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 11.2 ttm -106.97 -129.41 0.28 Allowed 'General case' 0 C--N 1.358 0.944 0 O-C-N 120.375 -1.453 . . . . 0.0 114.257 -174.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.38 79.99 1.4 Allowed 'General case' 0 C--N 1.358 0.967 0 C-N-CA 127.033 2.133 . . . . 0.0 110.579 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.343 75.3 p 77.61 55.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 127.138 2.175 . . . . 0.0 114.531 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.23 66.26 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 103.164 -2.902 . . . . 0.0 103.164 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.3 67.1 m 62.41 -48.02 0.18 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 130.21 3.404 . . . . 0.0 115.575 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 74.95 -92.06 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.483 3.113 . . . . 0.0 113.861 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.4 OUTLIER -173.31 14.05 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 112.414 -2.175 . . . . 0.0 115.138 -166.435 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.482 HD21 ' N ' ' A' ' 130' ' ' ASN . 1.0 OUTLIER -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 -102.85 155.69 18.17 Favored 'General case' 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.368 42.4 mmtm 75.97 32.92 0.62 Allowed 'General case' 0 C--N 1.353 0.742 0 C-N-CA 127.032 2.133 . . . . 0.0 116.459 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 89.0 mtp -76.28 -19.84 57.92 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 127.347 2.259 . . . . 0.0 113.089 174.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -99.49 -36.0 9.7 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 126.09 1.756 . . . . 0.0 114.583 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--N 1.362 1.124 0 O-C-N 120.702 -1.249 . . . . 0.0 111.601 -176.115 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -108.85 117.09 33.28 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.9 t -55.37 -35.5 37.27 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 129.531 3.132 . . . . 0.0 115.224 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.3 -27.64 66.48 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.785 2.834 . . . . 0.0 113.095 172.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.458 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.458 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.42 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.431 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HA ' ' HE3' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER -104.62 8.28 35.23 Favored 'General case' 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.25 22.45 12.42 Favored 'General case' 0 C--N 1.37 1.477 0 O-C-N 118.827 -2.42 . . . . 0.0 115.828 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.76 -12.7 63.85 Favored Glycine 0 C--N 1.356 1.681 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 153.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.373 4.0 pp -117.96 -53.75 2.36 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 118.643 2.831 . . . . 0.0 118.643 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -102.32 37.94 1.79 Allowed 'General case' 0 C--N 1.363 1.183 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.16 -177.9 50.83 Favored Glycine 0 C--N 1.352 1.472 0 C-N-CA 129.794 3.568 . . . . 0.0 114.633 -172.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.57 157.62 39.99 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -91.61 56.2 2.94 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 125.47 1.508 . . . . 0.0 110.185 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.256 65.9 mtt 72.42 -37.89 0.4 Allowed 'General case' 0 C--N 1.358 0.941 0 C-N-CA 130.14 3.376 . . . . 0.0 113.921 -173.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 80.51 -90.76 0.02 OUTLIER 'General case' 0 C--N 1.362 1.148 0 C-N-CA 130.41 3.484 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.1 t -122.16 6.02 9.74 Favored 'General case' 0 C--N 1.349 0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.453 0.3 OUTLIER 92.87 -34.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.373 0 C-N-CA 129.466 3.106 . . . . 0.0 112.43 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 74.9 m -102.46 85.6 2.64 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 127.231 2.213 . . . . 0.0 105.641 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.314 0.1 OUTLIER -74.3 -66.0 0.78 Allowed 'General case' 0 C--N 1.367 1.366 0 N-CA-C 119.059 2.985 . . . . 0.0 119.059 -169.624 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.02 58.36 0.03 OUTLIER 'General case' 0 C--N 1.362 1.138 0 O-C-N 120.328 -1.483 . . . . 0.0 113.71 -170.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.42 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.433 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.406 ' HA ' ' HE2' ' A' ' 68' ' ' LYS 0.477 0.0 OUTLIER 79.45 -55.11 0.42 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.335 10.0 pttt 123.92 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.353 0.755 1 C-N-CA 132.675 4.39 . . . . 0.0 109.069 173.231 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 12.4 ptp 46.3 -45.62 0.0 OUTLIER 'General case' 0 C--N 1.359 1.001 2 N-CA-C 122.539 4.274 . . . . 0.0 122.539 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 84.91 6.4 0.51 Allowed 'General case' 0 C--N 1.361 1.103 0 C-N-CA 129.664 3.186 . . . . 0.0 111.947 -173.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 . . . . . 0 C--N 1.361 1.071 0 C-N-CA 126.221 1.808 . . . . 0.0 111.137 -176.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 . . . . . 0 N--CA 1.441 -0.896 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -85.84 -12.42 50.83 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 126.9 2.08 . . . . 0.0 116.029 -174.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.33 -40.71 78.12 Favored 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 126.186 1.794 . . . . 0.0 112.619 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -68.68 -28.94 67.31 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 126.862 2.065 . . . . 0.0 115.196 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' CD2' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.442 ' CD2' ' CE1' ' A' ' 52' ' ' HIS . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.65 ' HZ1' HG12 ' A' ' 88' ' ' VAL 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.5 HD22 ' HB3' ' A' ' 134' ' ' LYS . 4.8 m-80 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.65 HG12 ' HZ1' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.433 ' HB ' ' HA ' ' A' ' 89' ' ' LEU . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -142.54 56.5 1.43 Allowed 'General case' 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -98.68 -29.65 12.9 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 125.445 1.498 . . . . 0.0 112.26 176.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 157.23 62.67 0.01 OUTLIER Glycine 0 CA--C 1.487 -1.692 0 N-CA-C 108.171 -1.972 . . . . 0.0 108.171 -166.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.611 ' CD1' ' H ' ' A' ' 106' ' ' THR . 0.4 OUTLIER -117.46 -73.06 0.66 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.363 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.611 ' H ' ' CD1' ' A' ' 105' ' ' LEU . 6.0 p -128.99 37.0 4.13 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 130.061 3.344 . . . . 0.0 111.016 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.41 -58.54 1.64 Allowed Glycine 0 C--N 1.361 1.944 0 C-N-CA 125.622 1.582 . . . . 0.0 114.556 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 156.68 -40.02 0.01 OUTLIER 'General case' 0 C--N 1.356 0.864 0 C-N-CA 127.858 2.463 . . . . 0.0 105.206 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.9 t -75.95 163.31 27.31 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.141 2.576 . . . . 0.0 112.68 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' MET . . . . . 0.492 ' HG3' ' H ' ' A' ' 111' ' ' ASP . 14.0 tpp -99.83 -160.74 0.82 Allowed 'General case' 0 C--N 1.355 0.841 0 C-N-CA 125.936 1.694 . . . . 0.0 112.267 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.492 ' H ' ' HG3' ' A' ' 110' ' ' MET . 1.2 p30 -88.85 154.23 20.42 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 128.911 2.884 . . . . 0.0 108.154 171.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 14.1 t -20.77 92.63 0.01 OUTLIER 'General case' 0 C--N 1.37 1.499 1 C-N-CA 132.808 4.443 . . . . 0.0 116.748 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.4 t -150.24 -70.3 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.283 0 N-CA-C 103.923 -2.621 . . . . 0.0 103.923 -165.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.4 t -102.13 38.61 1.63 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.36 55.3 p90 -161.13 141.21 10.89 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -125.15 140.84 52.51 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 174.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.49 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.49 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.524 ' HG2' ' H ' ' A' ' 134' ' ' LYS . 41.6 ttp180 -158.85 -147.0 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.524 ' H ' ' HG2' ' A' ' 133' ' ' ARG 0.281 7.2 tttt 3.22 0.83 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 2 C-N-CA 139.916 7.287 . . . . 0.0 126.923 177.493 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 23.9 ptp -19.26 18.12 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 2 C-N-CA 138.027 6.531 . . . . 0.0 124.64 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -78.99 67.13 4.61 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 126.875 2.07 . . . . 0.0 114.918 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 . . . . . 0 C--N 1.358 0.937 0 C-N-CA 126.247 1.819 . . . . 0.0 111.7 177.487 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 . . . . . 0 N--CA 1.444 -0.75 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 76.4 mtm180 -84.31 -47.84 10.34 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.537 1.935 . . . . 0.0 113.381 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.7 t -58.76 -34.8 53.04 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 C-N-CA 129.833 3.253 . . . . 0.0 115.362 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -68.21 -27.56 66.49 Favored 'General case' 0 C--N 1.367 1.361 0 C-N-CA 126.921 2.088 . . . . 0.0 114.516 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.422 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.404 HG11 HG22 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.404 HG22 HG11 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.447 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.289 2.4 t-20 -174.11 85.22 0.04 OUTLIER 'General case' 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -48.8 -47.38 42.18 Favored 'General case' 0 C--N 1.375 1.704 0 C-N-CA 128.042 2.537 . . . . 0.0 116.566 173.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.23 -46.88 0.05 OUTLIER Glycine 0 CA--C 1.479 -2.212 0 C-N-CA 119.123 -1.513 . . . . 0.0 110.341 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.359 1.3 pt? -118.11 -75.66 0.58 Allowed 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -175.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 p -112.0 17.84 19.3 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 111.585 -168.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 85.14 0.19 Allowed Glycine 0 CA--C 1.54 1.627 0 C-N-CA 130.597 3.951 . . . . 0.0 117.243 -174.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 179.77 -59.56 0.01 OUTLIER 'General case' 0 C--N 1.378 1.83 0 C-N-CA 127.741 2.416 . . . . 0.0 105.252 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.0 m -88.18 168.77 12.47 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.514 2.326 . . . . 0.0 111.626 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 21.7 mmt -90.87 98.55 11.84 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 120.216 -1.553 . . . . 0.0 113.395 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -107.86 24.8 12.39 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.506 1.922 . . . . 0.0 109.87 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.6 t 172.6 -160.26 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.611 1 N-CA-C 99.514 -4.254 . . . . 0.0 99.514 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.264 1.9 p 176.82 -18.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.617 1.967 . . . . 0.0 106.822 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 10.6 t -77.18 58.18 1.54 Allowed 'General case' 0 C--N 1.368 1.37 0 C-N-CA 128.509 2.724 . . . . 0.0 109.797 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -36.96 148.52 0.03 OUTLIER 'General case' 0 C--N 1.365 1.25 2 C-N-CA 135.772 5.629 . . . . 0.0 123.585 -169.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.431 HD21 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -94.6 -9.69 34.28 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.677 3.191 . . . . 0.0 116.785 -173.457 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.431 ' N ' HD21 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.553 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.553 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.447 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER 70.88 -43.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -171.77 -35.52 0.02 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.031 -2.951 . . . . 0.0 103.031 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.9 ttt 60.1 -48.8 0.09 Allowed 'General case' 0 C--N 1.35 0.63 1 C-N-CA 131.89 4.076 . . . . 0.0 117.019 177.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -166.47 -44.49 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 125.309 1.443 . . . . 0.0 109.048 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.358 0.967 0 C-N-CA 125.26 1.424 . . . . 0.0 113.096 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 . . . . . 0 N--CA 1.441 -0.904 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -85.11 -18.45 34.21 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.495 2.318 . . . . 0.0 114.232 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 p -72.44 -38.82 61.45 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 C-N-CA 128.149 2.579 . . . . 0.0 113.852 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -67.93 -27.61 66.78 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 127.324 2.249 . . . . 0.0 114.969 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.43 ' HA ' HG23 ' A' ' 64' ' ' VAL 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.43 HG23 ' HA ' ' A' ' 61' ' ' PRO 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.563 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.442 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 1.5 p30 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.429 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' HA ' HG21 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.412 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.76 58.58 0.74 Allowed 'General case' 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -92.32 -78.72 0.4 Allowed 'General case' 0 C--N 1.353 0.727 0 O-C-N 121.359 -0.838 . . . . 0.0 111.956 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.14 11.94 6.11 Favored Glycine 0 C--N 1.354 1.578 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.534 HD12 ' H ' ' A' ' 106' ' ' THR . 0.5 OUTLIER -103.1 -55.49 2.4 Favored 'General case' 0 C--N 1.35 0.607 0 C-N-CA 126.132 1.773 . . . . 0.0 108.516 -179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.534 ' H ' HD12 ' A' ' 105' ' ' LEU . 14.9 t -128.63 31.87 4.91 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.12 -40.73 23.92 Favored Glycine 0 C--N 1.361 1.948 0 C-N-CA 127.707 2.575 . . . . 0.0 114.354 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -168.0 -64.55 0.03 OUTLIER 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 101.032 -3.692 . . . . 0.0 101.032 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 m 153.95 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 131.33 3.852 . . . . 0.0 101.03 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -81.97 99.27 9.01 Favored 'General case' 0 C--N 1.362 1.142 0 O-C-N 120.734 -1.229 . . . . 0.0 112.442 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -128.68 119.13 24.08 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.363 63.6 p 80.75 42.44 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 126.36 1.864 . . . . 0.0 113.265 -179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.9 p -105.83 -18.74 6.89 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 C-N-CA 127.343 2.257 . . . . 0.0 114.676 -175.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.256 76.0 p 101.86 -92.42 0.0 OUTLIER 'General case' 0 C--N 1.371 1.508 1 N-CA-C 99.591 -4.226 . . . . 0.0 99.591 -167.178 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.327 1.5 t80 -165.89 143.25 5.5 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 155.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -60.33 -5.56 1.18 Allowed 'General case' 0 C--N 1.351 0.668 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 -168.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.493 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.493 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.563 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.442 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 -120.05 -2.71 10.19 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 132' ' ' TYR . 0.5 OUTLIER -82.93 -37.45 24.14 Favored 'General case' 0 C--N 1.358 0.966 0 O-C-N 119.125 -2.235 . . . . 0.0 113.656 -177.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 5.6 ttt -36.46 39.93 0.0 OUTLIER 'General case' 0 C--N 1.363 1.171 2 C-N-CA 135.38 5.472 . . . . 0.0 122.159 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -88.34 68.7 8.97 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 119.236 -2.165 . . . . 0.0 111.265 176.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 . . . . . 0 C--N 1.359 0.983 0 C-N-CA 125.708 1.603 . . . . 0.0 111.26 -176.204 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.312 37.9 mmt180 95.23 -35.38 0.02 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.129 3.371 . . . . 0.0 113.748 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -62.61 -45.39 98.93 Favored 'Isoleucine or valine' 0 C--N 1.367 1.327 0 C-N-CA 126.522 1.929 . . . . 0.0 115.554 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER -68.85 -28.74 66.99 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 174.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.417 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 117' ' ' PHE . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.417 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.501 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.424 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.441 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -20.77 66.55 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.1 13.19 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 119.966 -1.709 . . . . 0.0 115.149 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -87.46 -9.32 72.64 Favored Glycine 0 C--N 1.361 1.939 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 158.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.394 4.3 pp -118.19 -50.29 2.47 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 117.74 2.496 . . . . 0.0 117.74 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -102.34 32.81 3.37 Favored 'General case' 0 C--N 1.365 1.251 0 CA-C-O 124.032 1.872 . . . . 0.0 106.801 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.35 54.54 0.45 Allowed Glycine 0 CA--C 1.538 1.528 1 C-N-CA 131.837 4.541 . . . . 0.0 117.113 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -103.71 69.79 0.99 Allowed 'General case' 0 C--N 1.366 1.292 0 C-N-CA 128.098 2.559 . . . . 0.0 108.04 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.339 60.2 p 87.41 -112.94 0.01 OUTLIER 'General case' 0 C--N 1.35 0.607 0 C-N-CA 128.151 2.58 . . . . 0.0 110.37 -173.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.3 ptp -139.92 39.65 1.98 Allowed 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -49.69 -52.14 33.29 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 128.22 2.608 . . . . 0.0 116.549 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 2.0 p -118.14 52.85 0.99 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 127.851 2.46 . . . . 0.0 107.76 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.1 t -140.79 -49.74 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -176.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.5 t -90.56 31.63 1.02 Allowed 'General case' 0 C--N 1.369 1.45 0 O-C-N 119.938 -1.726 . . . . 0.0 110.072 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.07 -159.97 0.29 Allowed 'General case' 0 C--N 1.361 1.099 0 C-N-CA 130.26 3.424 . . . . 0.0 115.295 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.68 130.81 13.52 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 119.408 -2.058 . . . . 0.0 115.62 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.501 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 166.75 -156.33 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.98 -5.89 56.53 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 127.861 2.464 . . . . 0.0 111.849 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 45.8 mtt 64.65 -43.04 0.3 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.78 3.232 . . . . 0.0 116.168 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 71.55 -54.01 0.68 Allowed 'General case' 0 C--N 1.362 1.14 0 C-N-CA 130.123 3.369 . . . . 0.0 115.383 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 C--N 1.353 0.754 0 C-N-CA 126.46 1.904 . . . . 0.0 109.398 179.046 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 . . . . . 0 N--CA 1.437 -1.105 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 81.66 93.68 0.04 OUTLIER 'General case' 0 C--N 1.364 1.216 0 C-N-CA 127.859 2.464 . . . . 0.0 113.234 177.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.6 m -54.17 -33.82 25.85 Favored 'Isoleucine or valine' 0 C--N 1.37 1.481 0 C-N-CA 129.187 2.995 . . . . 0.0 114.974 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -66.33 -27.34 67.82 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.57 2.748 . . . . 0.0 113.852 173.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.434 ' CG2' ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.434 ' H ' ' CG2' ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.464 ' HZ2' ' HB3' ' A' ' 133' ' ' ARG 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.419 ' HA ' HG21 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.419 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 7.5 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -94.91 -48.62 5.93 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . 0.387 . . -49.69 37.68 0.0 OUTLIER 'General case' 0 C--N 1.366 1.3 1 N-CA-C 123.092 4.478 . . . . 0.0 123.092 -174.666 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -95.67 11.75 68.06 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 118.531 -2.606 . . . . 0.0 110.797 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' HG ' ' N ' ' A' ' 106' ' ' THR . 2.6 pt? -117.86 -65.52 1.17 Allowed 'General case' 0 CA--C 1.501 -0.908 0 C-N-CA 127.81 2.444 . . . . 0.0 112.932 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.434 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 13.1 t -82.51 -37.65 24.95 Favored 'General case' 0 CA--C 1.495 -1.145 0 C-N-CA 129.45 3.1 . . . . 0.0 107.806 -175.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -76.73 32.61 1.44 Allowed Glycine 0 C--N 1.362 2.022 0 N-CA-C 117.818 1.887 . . . . 0.0 117.818 175.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -148.22 138.1 22.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 120.169 -1.783 . . . . 0.0 109.456 -169.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.355 60.4 p 88.23 -12.74 0.44 Allowed 'General case' 0 C--N 1.362 1.142 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 39.8 mtt 77.78 58.09 0.03 OUTLIER 'General case' 0 C--N 1.358 0.968 0 C-N-CA 127.15 2.18 . . . . 0.0 113.594 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -89.77 65.94 6.93 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 126.366 1.866 . . . . 0.0 110.775 178.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.2 m 135.4 -63.73 0.0 OUTLIER 'General case' 0 C--N 1.358 0.956 0 C-N-CA 130.654 3.582 . . . . 0.0 105.121 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.418 0.4 OUTLIER 113.06 -21.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 130.548 3.539 . . . . 0.0 110.916 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.418 ' HA ' ' CE2' ' A' ' 117' ' ' PHE . 66.8 m -116.39 36.15 4.23 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.036 1.735 . . . . 0.0 110.697 179.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -52.64 14.22 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 1 C-N-CA 133.225 4.61 . . . . 0.0 119.9 -175.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 -153.04 -44.27 0.1 Allowed 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 126.625 1.97 . . . . 0.0 108.189 -170.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.435 ' CD1' ' N ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.4 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.535 ' CD1' ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.464 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 5.1 tmm_? -102.25 112.54 25.27 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.413 ' HZ2' ' HB1' ' A' ' 136' ' ' ALA 0.257 11.8 tmtt? 136.06 -66.56 0.0 OUTLIER 'General case' 0 C--N 1.363 1.194 0 C-N-CA 128.208 2.603 . . . . 0.0 105.329 -178.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 64.6 mtt 71.86 -43.89 0.58 Allowed 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.072 2.949 . . . . 0.0 114.949 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.413 ' HB1' ' HZ2' ' A' ' 134' ' ' LYS 0.275 . . 97.99 -133.39 0.0 OUTLIER 'General case' 0 C--N 1.358 0.937 0 C-N-CA 130.732 3.613 . . . . 0.0 111.797 178.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 . . . . . 0 C--N 1.353 0.727 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -178.341 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 . . . . . 0 N--CA 1.44 -0.971 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -120.69 142.25 49.66 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.414 1.886 . . . . 0.0 107.608 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.07 -34.1 61.7 Favored 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 130.306 3.443 . . . . 0.0 113.558 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -67.94 -27.87 66.99 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 128.362 2.665 . . . . 0.0 114.291 174.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HE2' HD22 ' A' ' 73' ' ' ASN 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.498 HD22 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.416 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.416 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.425 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.7 -55.3 1.72 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.96 11.68 22.05 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 117.721 2.489 . . . . 0.0 117.721 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.35 -11.09 72.81 Favored Glycine 0 C--N 1.355 1.6 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 155.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.438 4.5 pp -118.8 -50.52 2.4 Favored 'General case' 0 C--N 1.368 1.392 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.8 t -114.58 37.62 3.35 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.752 2.021 . . . . 0.0 105.758 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.79 -43.56 27.9 Favored Glycine 0 C--N 1.359 1.822 0 C-N-CA 127.313 2.387 . . . . 0.0 116.184 -169.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.324 77.5 mtp180 89.9 39.66 0.01 OUTLIER 'General case' 0 C--N 1.364 1.238 0 C-N-CA 127.104 2.161 . . . . 0.0 112.779 169.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.2 t -175.56 172.09 2.67 Favored 'General case' 0 N--CA 1.442 -0.871 1 N-CA-C 98.883 -4.488 . . . . 0.0 98.883 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 36.6 ttm -92.37 -115.78 0.09 Allowed 'General case' 0 C--N 1.362 1.117 0 CA-C-N 119.978 1.263 . . . . 0.0 113.151 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -90.06 -71.2 0.63 Allowed 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.614 1.565 . . . . 0.0 112.07 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.291 10.3 t -148.4 80.23 1.45 Allowed 'General case' 0 C--N 1.349 0.571 0 N-CA-C 104.253 -2.499 . . . . 0.0 104.253 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.7 t -113.99 -86.01 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.6 t -115.83 82.62 1.8 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.432 ' CD2' ' CE2' ' A' ' 117' ' ' PHE . 0.4 OUTLIER -93.12 154.79 17.88 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 119.726 3.232 . . . . 0.0 119.726 -171.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.409 ' HB2' ' HG2' ' A' ' 120' ' ' GLU . 0.1 OUTLIER -94.49 -4.61 47.82 Favored 'General case' 0 C--N 1.354 0.791 0 C-N-CA 130.78 3.632 . . . . 0.0 116.404 -173.674 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 115' ' ' TYR . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.409 ' HG2' ' HB2' ' A' ' 116' ' ' ASN . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? 62.33 -78.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -77.42 51.68 0.89 Allowed 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.311 2.644 . . . . 0.0 114.781 -172.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 11.2 tpt -65.52 51.89 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 130.549 3.54 . . . . 0.0 116.144 -177.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -107.02 -4.29 19.15 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 119.652 -1.905 . . . . 0.0 110.989 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 . . . . . 0 C--N 1.356 0.865 0 C-N-CA 125.551 1.54 . . . . 0.0 107.454 -177.492 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -117.87 127.88 54.29 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 103.972 -2.603 . . . . 0.0 103.972 176.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.3 t -55.66 -43.76 74.41 Favored 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.121 2.568 . . . . 0.0 116.011 -174.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? -68.05 -28.02 67.02 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 126.266 1.826 . . . . 0.0 114.218 174.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.464 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.583 ' HZ2' ' H ' ' A' ' 134' ' ' LYS 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HB ' ' HB ' ' A' ' 60' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 106.16 81.78 0.0 OUTLIER 'General case' 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.12 71.04 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 126.454 1.902 . . . . 0.0 114.426 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 158.96 -22.87 0.31 Allowed Glycine 0 CA--C 1.487 -1.663 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.641 167.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.287 0.2 OUTLIER -117.76 -81.28 0.62 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.165 0.983 . . . . 0.0 113.338 -176.507 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.5 p -115.81 31.2 6.86 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.119 1.768 . . . . 0.0 111.363 -168.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.58 92.22 1.79 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 129.611 3.481 . . . . 0.0 109.744 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.256 29.5 mmt180 120.13 -32.02 0.01 OUTLIER 'General case' 0 C--N 1.38 1.93 0 C-N-CA 128.607 2.763 . . . . 0.0 105.391 -170.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.3 m -76.11 62.44 1.69 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.558 1.943 . . . . 0.0 115.96 -174.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 9.8 mmt -92.55 85.97 5.47 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 126.575 1.95 . . . . 0.0 111.591 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.5 63.31 0.61 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 126.546 1.938 . . . . 0.0 108.568 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 52.4 m -178.48 -74.74 0.01 OUTLIER 'General case' 0 C--N 1.35 0.595 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.603 0.3 OUTLIER 80.67 37.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.358 0.96 0 CA-C-O 126.201 2.905 . . . . 0.0 114.992 177.262 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 71.0 m -158.65 54.8 0.43 Allowed 'General case' 0 CA--C 1.515 -0.376 1 N-CA-C 100.038 -4.06 . . . . 0.0 100.038 173.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.388 0.8 OUTLIER -93.5 161.21 14.46 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 -163.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.94 40.77 0.03 OUTLIER 'General case' 0 C--N 1.35 0.623 1 C-N-CA 135.318 5.447 . . . . 0.0 121.082 -173.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.416 ' CD2' ' HB2' ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.435 ' HB2' ' H ' ' A' ' 133' ' ' ARG . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.521 ' HE ' ' HG2' ' A' ' 134' ' ' LYS 0.332 9.3 ptm180 -85.23 -66.66 0.87 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.583 ' H ' ' HZ2' ' A' ' 68' ' ' LYS . 4.7 mmmp? -81.03 39.57 0.5 Allowed 'General case' 0 C--N 1.37 1.464 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 15.0 tpt -92.09 -49.66 6.09 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 128.179 2.592 . . . . 0.0 109.18 174.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . 0.259 . . 93.74 36.84 0.01 OUTLIER 'General case' 0 C--N 1.363 1.189 0 C-N-CA 129.324 3.05 . . . . 0.0 112.911 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 . . . . . 0 C--N 1.362 1.114 0 C-N-CA 125.235 1.414 . . . . 0.0 109.162 176.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -59.16 -35.39 73.44 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 127.947 2.499 . . . . 0.0 116.598 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -72.49 -44.07 62.31 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 126.556 1.942 . . . . 0.0 113.434 174.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -68.82 -28.94 67.19 Favored 'General case' 0 C--N 1.375 1.687 0 C-N-CA 126.992 2.117 . . . . 0.0 113.994 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.456 HG23 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.456 ' HB ' HG23 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.462 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.465 2.3 t-20 175.67 85.31 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.14 79.7 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 169.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.36 -9.34 3.5 Favored Glycine 0 C--N 1.36 1.915 0 CA-C-N 116.431 -0.35 . . . . 0.0 112.981 168.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.485 ' CD1' ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -105.0 -81.77 0.53 Allowed 'General case' 0 C--N 1.351 0.646 0 O-C-N 120.895 -1.356 . . . . 0.0 111.387 -175.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.485 ' H ' ' CD1' ' A' ' 105' ' ' LEU . 6.8 t -129.74 24.84 5.37 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.654 1.982 . . . . 0.0 110.308 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.1 68.93 2.91 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 120.718 -1.239 . . . . 0.0 113.42 -167.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.2 ptt-85 -161.96 32.35 0.12 Allowed 'General case' 0 C--N 1.35 0.592 0 CA-C-N 120.062 1.931 . . . . 0.0 106.622 -178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 64.8 m 73.94 79.19 0.12 Allowed 'General case' 0 C--N 1.365 1.27 0 C-N-CA 127.499 2.32 . . . . 0.0 113.875 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.27 112.69 24.46 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -76.6 -21.14 55.96 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 118.473 2.768 . . . . 0.0 118.473 -169.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.5 t -128.37 49.26 2.2 Favored 'General case' 0 C--N 1.348 0.543 0 C-N-CA 124.955 1.302 . . . . 0.0 108.795 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 p -118.16 4.67 7.05 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 O-C-N 121.34 -0.85 . . . . 0.0 112.222 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.5 m 74.58 48.83 0.11 Allowed 'General case' 0 C--N 1.369 1.415 0 C-N-CA 127.723 2.409 . . . . 0.0 108.216 -170.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -62.49 63.98 0.01 OUTLIER 'General case' 0 C--N 1.364 1.208 0 C-N-CA 130.898 3.679 . . . . 0.0 117.1 -168.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -120.36 125.93 49.24 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.462 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.418 ' CD2' ' N ' ' A' ' 133' ' ' ARG . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 24.02 66.13 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 30.7 mmmt 82.19 47.02 0.02 OUTLIER 'General case' 0 C--N 1.367 1.343 0 C-N-CA 128.487 2.715 . . . . 0.0 111.897 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.2 ttt -62.37 -27.09 68.83 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.937 3.295 . . . . 0.0 116.688 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -164.33 167.8 19.38 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 104.669 -2.345 . . . . 0.0 104.669 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 . . . . . 0 C--N 1.357 0.907 0 N-CA-C 106.603 -1.629 . . . . 0.0 106.603 179.056 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -86.53 -2.59 58.6 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.77 2.428 . . . . 0.0 115.888 -176.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.2 t -67.34 -54.19 26.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.2 0 C-N-CA 127.255 2.222 . . . . 0.0 114.352 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -68.73 -27.33 65.84 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.581 3.152 . . . . 0.0 112.421 173.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.421 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.428 ' HA ' HG21 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.428 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.501 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER -77.42 -10.21 59.33 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.04 16.69 17.24 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 120.539 -1.351 . . . . 0.0 114.42 174.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.03 -11.9 66.75 Favored Glycine 0 C--N 1.362 1.974 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 154.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.449 ' C ' ' H ' ' A' ' 107' ' ' GLY 0.4 4.0 pp -118.4 -51.89 2.39 Favored 'General case' 0 C--N 1.368 1.386 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 177.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.2 m -89.53 28.14 1.35 Allowed 'General case' 0 C--N 1.369 1.428 0 C-N-CA 129.632 3.173 . . . . 0.0 106.863 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.449 ' H ' ' C ' ' A' ' 105' ' ' LEU . . . -75.96 -32.41 53.16 Favored Glycine 0 C--N 1.353 1.519 0 C-N-CA 129.186 3.279 . . . . 0.0 116.285 -164.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -104.36 -9.27 18.62 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 126.938 2.095 . . . . 0.0 111.808 177.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.8 p -125.82 25.89 6.76 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.095 1.758 . . . . 0.0 111.967 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 88.3 mtp -18.29 33.86 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 2 C-N-CA 135.956 5.703 . . . . 0.0 124.32 -176.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.8 t70 80.95 -64.91 0.16 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 130.889 3.675 . . . . 0.0 110.204 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 17.3 p -133.99 -66.78 0.61 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 100.908 -3.738 . . . . 0.0 100.908 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.36 2.5 p 115.29 128.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.948 1 C-N-CA 132.644 4.378 . . . . 0.0 105.781 174.545 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 5.3 t 79.03 44.15 0.06 Allowed 'General case' 0 C--N 1.37 1.478 0 C-N-CA 125.218 1.407 . . . . 0.0 109.599 -174.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -85.04 168.2 15.13 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 129.681 3.192 . . . . 0.0 115.362 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -116.62 140.43 49.4 Favored 'General case' 0 C--N 1.359 0.997 0 O-C-N 120.562 -1.336 . . . . 0.0 107.788 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.483 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.483 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HB2' ' HZ1' ' A' ' 127' ' ' LYS . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.498 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -61.65 -31.29 71.39 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -18.17 50.88 Favored 'General case' 0 C--N 1.384 2.082 0 CA-C-N 122.07 2.213 . . . . 0.0 115.234 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 20.4 mmt -90.71 -6.95 53.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 129.496 3.118 . . . . 0.0 114.083 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.01 54.39 1.89 Allowed 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.249 1.82 . . . . 0.0 113.944 178.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--N 1.353 0.719 0 C-N-CA 125.986 1.715 . . . . 0.0 109.128 -177.013 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 68.62 -51.33 0.57 Allowed 'General case' 0 C--N 1.363 1.186 0 C-N-CA 128.246 2.619 . . . . 0.0 115.717 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.7 m -60.78 -34.34 58.73 Favored 'Isoleucine or valine' 0 C--N 1.369 1.453 0 C-N-CA 129.921 3.288 . . . . 0.0 113.904 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER -62.87 -27.34 69.28 Favored 'General case' 0 C--N 1.366 1.317 0 C-N-CA 129.139 2.976 . . . . 0.0 114.777 173.022 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.609 ' HZ1' ' HA ' ' A' ' 130' ' ' ASN 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.45 ' HA ' HG21 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.463 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 14.16 -78.23 0.0 OUTLIER 'General case' 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.58 -38.93 6.27 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 110.481 -3.054 . . . . 0.0 114.977 -175.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.48 46.94 Favored Glycine 0 C--N 1.365 2.177 0 C-N-CA 126.023 1.773 . . . . 0.0 115.712 174.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -116.89 -53.95 2.45 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 125.423 1.489 . . . . 0.0 112.443 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.9 t -108.25 35.63 3.09 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 129.142 2.977 . . . . 0.0 108.459 -177.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.18 3.29 59.98 Favored Glycine 0 N--CA 1.435 -1.433 0 C-N-CA 128.451 2.929 . . . . 0.0 114.136 -177.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -101.79 -154.38 0.48 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.4 p -93.42 118.79 31.75 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 120.387 -1.445 . . . . 0.0 107.743 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 86.8 mtp -71.84 -10.77 60.26 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.247 2.219 . . . . 0.0 115.3 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.266 37.5 m-20 82.85 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 130.599 3.56 . . . . 0.0 112.515 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 38.3 p -81.98 68.1 8.24 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.511 1.924 . . . . 0.0 112.8 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.32 5.61 10.43 Favored 'Isoleucine or valine' 0 C--N 1.348 0.532 0 C-N-CA 126.459 1.904 . . . . 0.0 109.757 -177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.1 m 64.69 36.29 8.33 Favored 'General case' 0 C--N 1.374 1.662 0 C-N-CA 129.5 3.12 . . . . 0.0 111.214 -175.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.519 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE 0.502 0.2 OUTLIER 5.79 76.35 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 1 C-N-CA 133.767 4.827 . . . . 0.0 121.154 -169.44 . . . . . . . . 5 4 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -40.55 26.17 0.0 OUTLIER 'General case' 0 C--N 1.351 0.654 2 C-N-CA 136.56 5.944 . . . . 0.0 123.374 -178.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CZ ' ' CD1' ' A' ' 115' ' ' TYR 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.463 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.471 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.471 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.609 ' HA ' ' HZ1' ' A' ' 68' ' ' LYS . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.501 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.501 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 -117.86 -39.76 3.07 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -94.64 -20.71 19.34 Favored 'General case' 0 C--N 1.365 1.273 0 CA-C-N 121.315 1.87 . . . . 0.0 114.823 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 42.0 mtt 66.82 -60.06 0.36 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 127.181 2.192 . . . . 0.0 116.555 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 76.51 -52.57 0.59 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 130.214 3.406 . . . . 0.0 113.411 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.36 1.065 0 C-N-CA 126.325 1.85 . . . . 0.0 111.119 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.548 HE22 HH21 ' A' ' 43' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 121.405 0.622 . . . . 0.0 109.406 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.14 -27.68 68.9 Favored 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.57 2.748 . . . . 0.0 114.799 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 m -64.46 -33.78 65.17 Favored 'Isoleucine or valine' 0 C--N 1.365 1.243 0 C-N-CA 129.638 3.175 . . . . 0.0 112.724 173.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm -67.13 -27.0 66.95 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 128.413 2.685 . . . . 0.0 113.989 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.548 HH21 HE22 ' A' ' 39' ' ' GLN . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.401 ' HE2' ' CE2' ' A' ' 99' ' ' TYR . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.44 ' H ' HG11 ' A' ' 60' ' ' VAL 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.418 ' HA ' HG12 ' A' ' 64' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HZ2' ' HB3' ' A' ' 75' ' ' PHE . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.566 ' ND2' ' H ' ' A' ' 134' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.565 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.438 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -98.96 -0.7 41.61 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.458 ' HB3' ' HA3' ' A' ' 107' ' ' GLY . . . -104.76 23.49 13.35 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 120.923 3.675 . . . . 0.0 120.923 -167.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -81.05 -8.48 87.35 Favored Glycine 0 C--N 1.352 1.444 0 O-C-N 118.497 -2.627 . . . . 0.0 112.204 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -118.82 -60.9 1.71 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 128.664 2.786 . . . . 0.0 116.446 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.1 t -87.58 -10.21 52.17 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 125.187 1.395 . . . . 0.0 111.18 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' A' ' 103' ' ' ALA . . . -78.4 17.8 6.12 Favored Glycine 0 C--N 1.354 1.582 0 C-N-CA 128.874 3.131 . . . . 0.0 117.343 -169.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -157.82 8.53 0.16 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.642 2.777 . . . . 0.0 110.352 -170.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.5 m -97.22 71.74 2.41 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 174.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.0 mtt -50.62 -49.14 57.5 Favored 'General case' 0 C--N 1.366 1.286 0 C-N-CA 129.723 3.209 . . . . 0.0 118.912 -168.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.7 t70 66.63 -78.88 0.04 OUTLIER 'General case' 0 C--N 1.37 1.491 0 C-N-CA 126.942 2.097 . . . . 0.0 114.274 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 43.2 p -98.93 -41.86 7.4 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.65 1.98 . . . . 0.0 110.436 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.479 0.3 OUTLIER 103.99 -18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.043 0 C-N-CA 130.72 3.608 . . . . 0.0 111.419 -176.23 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.5 t -95.99 9.48 40.59 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.817 1.647 . . . . 0.0 110.624 171.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 43.7 -93.97 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 130.379 3.472 . . . . 0.0 118.616 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 4.06 0.12 Allowed 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.721 2.009 . . . . 0.0 114.178 -165.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.412 ' CE2' ' HD2' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -98.18 -41.11 8.05 Favored 'General case' 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.566 ' H ' ' ND2' ' A' ' 73' ' ' ASN 0.436 0.0 OUTLIER -40.86 -41.37 1.58 Allowed 'General case' 0 C--N 1.376 1.735 0 N-CA-C 120.047 3.351 . . . . 0.0 120.047 -174.406 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -15.94 61.3 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 175.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -100.85 5.62 43.47 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 126.694 1.998 . . . . 0.0 114.662 -174.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 . . . . . 0 C--N 1.364 1.214 0 C-N-CA 128.636 2.774 . . . . 0.0 115.31 176.56 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.5 ptt85 -90.01 -12.47 38.5 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.921 2.088 . . . . 0.0 113.927 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.7 t -70.5 -45.26 75.44 Favored 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 127.096 2.158 . . . . 0.0 114.295 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? -68.12 -26.39 65.77 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.664 1.986 . . . . 0.0 113.437 173.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.486 HG13 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' HG13 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -73.19 14.16 0.34 Allowed 'General case' 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -36.99 -34.61 0.08 Allowed 'General case' 0 C--N 1.366 1.292 1 C-N-CA 132.953 4.501 . . . . 0.0 120.633 -171.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.68 42.16 0.09 OUTLIER Glycine 0 CA--C 1.481 -2.089 0 N-CA-C 107.847 -2.101 . . . . 0.0 107.847 165.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.408 HD11 ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -118.07 -77.44 0.57 Allowed 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 122.886 1.327 . . . . 0.0 108.654 -177.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.408 ' H ' HD11 ' A' ' 105' ' ' LEU . 97.9 m -79.37 -35.26 41.11 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 129.153 2.981 . . . . 0.0 111.452 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.74 82.59 0.5 Allowed Glycine 0 C--N 1.361 1.955 0 C-N-CA 128.905 3.145 . . . . 0.0 115.898 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -55.09 83.82 0.0 OUTLIER 'General case' 0 C--N 1.372 1.556 0 C-N-CA 128.322 2.649 . . . . 0.0 115.642 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.6 t 74.6 28.09 1.27 Allowed 'General case' 0 C--N 1.368 1.399 0 C-N-CA 129.679 3.191 . . . . 0.0 111.22 -173.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.345 10.8 ttt 51.56 35.38 14.48 Favored 'General case' 0 C--N 1.371 1.519 1 C-N-CA 132.194 4.198 . . . . 0.0 116.647 -176.602 . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 69.16 16.79 8.52 Favored 'General case' 0 C--N 1.365 1.255 0 C-N-CA 129.194 2.997 . . . . 0.0 113.801 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.352 0.7 OUTLIER 112.41 -31.07 0.01 OUTLIER 'General case' 0 C--N 1.361 1.066 0 C-N-CA 131.683 3.993 . . . . 0.0 110.153 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.43 0.4 OUTLIER 88.48 146.73 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.36 0 C-N-CA 126.662 1.985 . . . . 0.0 111.847 -178.279 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 16.0 t 72.16 28.08 2.51 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 125.494 1.517 . . . . 0.0 110.054 -168.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -52.2 172.2 0.04 OUTLIER 'General case' 0 C--N 1.366 1.323 1 C-N-CA 134.776 5.23 . . . . 0.0 120.666 -174.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.12 130.98 14.19 Favored 'General case' 0 C--N 1.365 1.246 0 O-C-N 119.72 -1.862 . . . . 0.0 114.708 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.447 ' HB2' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.412 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.67 -24.01 18.03 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -29.39 67.9 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -171.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 19.6 ptp -107.94 23.4 14.54 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 125.56 1.544 . . . . 0.0 112.214 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -72.79 60.86 0.52 Allowed 'General case' 0 C--N 1.361 1.085 0 C-N-CA 127.248 2.219 . . . . 0.0 115.67 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 . . . . . 0 C--N 1.359 1.015 0 C-N-CA 129.572 3.149 . . . . 0.0 113.316 179.417 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 . . . . . 0 N--CA 1.443 -0.825 0 CA-C-O 121.339 0.59 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -104.93 123.08 47.13 Favored 'General case' 0 C--N 1.348 0.53 0 C-N-CA 126.43 1.892 . . . . 0.0 107.6 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.85 -35.85 72.92 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 127.55 2.34 . . . . 0.0 116.081 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -68.4 -26.76 65.71 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 128.629 2.772 . . . . 0.0 112.816 172.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.406 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 4 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.458 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER 96.13 65.66 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.18 22.43 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.61 27.13 55.2 Favored Glycine 0 C--N 1.366 2.203 0 C-N-CA 127.797 2.618 . . . . 0.0 116.634 174.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.4 pp -117.3 -36.92 3.63 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 126.664 1.986 . . . . 0.0 114.077 -175.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.4 t -117.69 25.07 10.66 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.713 2.405 . . . . 0.0 106.956 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -87.2 9.29 73.4 Favored Glycine 0 C--N 1.363 2.067 0 C-N-CA 127.403 2.43 . . . . 0.0 118.441 -165.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -104.91 30.22 5.69 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 125.739 1.616 . . . . 0.0 111.373 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.325 86.8 p 73.65 16.22 3.92 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 127.303 2.241 . . . . 0.0 116.219 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.4 mtp -63.11 51.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 131.383 3.873 . . . . 0.0 117.819 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -79.17 61.18 3.23 Favored 'General case' 0 C--N 1.357 0.914 0 O-C-N 119.317 -2.114 . . . . 0.0 113.168 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.391 22.1 p 125.4 122.01 0.0 OUTLIER 'General case' 0 C--N 1.356 0.848 1 C-N-CA 132.97 4.508 . . . . 0.0 107.803 -178.365 . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 9.8 p -164.68 -178.18 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 100.334 -3.95 . . . . 0.0 100.334 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.7 m -72.33 53.85 0.3 Allowed 'General case' 0 C--N 1.364 1.205 0 C-N-CA 127.892 2.477 . . . . 0.0 112.25 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -33.48 123.95 0.42 Allowed 'General case' 0 C--N 1.36 1.026 2 C-N-CA 135.794 5.638 . . . . 0.0 121.894 -170.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.98 23.26 0.01 OUTLIER 'General case' 0 C--N 1.356 0.858 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.458 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.409 ' O ' ' CD2' ' A' ' 132' ' ' TYR . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.409 ' CD2' ' O ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -94.04 -51.42 4.86 Favored 'General case' 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 39.39 0.73 Allowed 'General case' 0 C--N 1.37 1.487 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -174.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.3 mmt -132.02 -0.47 3.77 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 129.319 3.047 . . . . 0.0 107.427 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.93 151.97 44.65 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 125.059 1.344 . . . . 0.0 109.115 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 C--N 1.368 1.377 0 C-N-CA 125.463 1.505 . . . . 0.0 111.636 -179.717 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.6 mmt-85 -98.67 89.79 4.49 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.389 1.876 . . . . 0.0 106.77 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.8 t -53.94 -35.81 29.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.284 0 C-N-CA 129.243 3.017 . . . . 0.0 115.628 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -68.42 -27.61 66.35 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.237 2.215 . . . . 0.0 113.827 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.417 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 92' ' ' VAL . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 89' ' ' LEU . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.434 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -161.34 55.44 0.28 Allowed 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.78 -78.94 0.52 Allowed 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.371 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -161.64 35.91 0.38 Allowed Glycine 0 C--N 1.352 1.468 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.461 HD21 ' H ' ' A' ' 105' ' ' LEU . 0.9 OUTLIER -116.4 -66.4 1.09 Allowed 'General case' 0 C--N 1.348 0.514 0 C-N-CA 125.505 1.522 . . . . 0.0 107.461 177.797 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.41 ' H ' ' CD2' ' A' ' 105' ' ' LEU . 11.7 t -108.5 18.41 20.97 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 127.844 2.458 . . . . 0.0 108.722 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.66 -5.49 81.59 Favored Glycine 0 C--N 1.366 2.247 0 C-N-CA 127.223 2.344 . . . . 0.0 115.601 -179.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 171.6 -93.22 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 101.591 -3.485 . . . . 0.0 101.591 -176.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 t -176.8 53.01 0.01 OUTLIER 'General case' 0 C--N 1.348 0.524 0 N-CA-C 102.857 -3.016 . . . . 0.0 102.857 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.314 55.1 mtp 82.78 87.35 0.03 OUTLIER 'General case' 0 C--N 1.358 0.969 0 C-N-CA 127.99 2.516 . . . . 0.0 113.499 -176.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -73.68 -41.53 62.53 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.226 2.61 . . . . 0.0 111.113 176.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.8 t -161.9 168.89 22.19 Favored 'General case' 0 N--CA 1.437 -1.096 1 N-CA-C 99.607 -4.22 . . . . 0.0 99.607 178.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.1 p -155.25 -43.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.895 0 CA-C-N 119.664 1.12 . . . . 0.0 110.647 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 p -90.24 60.46 4.77 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 126.836 2.055 . . . . 0.0 107.315 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.27 159.68 15.5 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 128.851 2.861 . . . . 0.0 116.582 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -126.7 136.19 52.13 Favored 'General case' 0 C--N 1.356 0.85 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 175.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.44 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 116.12 15.52 Favored 'General case' 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.42 14.3 mmmm 102.25 -9.3 0.03 OUTLIER 'General case' 0 C--N 1.377 1.774 0 C-N-CA 128.896 2.878 . . . . 0.0 113.604 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.3 mmm -110.74 27.66 9.44 Favored 'General case' 0 C--N 1.361 1.103 0 O-C-N 120.209 -1.557 . . . . 0.0 111.647 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -84.87 42.69 0.94 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.977 2.511 . . . . 0.0 113.516 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 . . . . . 0 C--N 1.354 0.789 0 C-N-CA 125.807 1.643 . . . . 0.0 107.866 179.918 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -133.41 45.32 2.7 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 125.688 1.595 . . . . 0.0 108.941 -177.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.7 p -54.8 -41.45 57.0 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 130.807 3.643 . . . . 0.0 116.418 -176.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER -67.01 -27.32 67.32 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 127.579 2.352 . . . . 0.0 114.729 174.509 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.413 ' HA ' HG11 ' A' ' 64' ' ' VAL . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.413 HG11 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.438 HG12 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.562 ' CD1' HG21 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.21 -9.8 55.86 Favored 'General case' 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.6 35.62 0.83 Allowed 'General case' 0 C--N 1.361 1.108 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.1 -24.05 42.46 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 162.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.301 2.3 pt? -118.53 -57.82 2.03 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 117.629 2.455 . . . . 0.0 117.629 -177.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.3 t -97.61 37.2 1.4 Allowed 'General case' 0 C--N 1.363 1.177 0 C-N-CA 127.979 2.512 . . . . 0.0 106.782 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.81 178.41 53.68 Favored Glycine 0 C--N 1.351 1.397 1 C-N-CA 132.059 4.647 . . . . 0.0 113.694 -178.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.7 ttp85 144.03 -29.94 0.01 OUTLIER 'General case' 0 C--N 1.368 1.402 0 N-CA-C 101.092 -3.67 . . . . 0.0 101.092 -173.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 m -45.93 76.49 0.0 OUTLIER 'General case' 0 C--N 1.371 1.529 1 C-N-CA 134.488 5.115 . . . . 0.0 116.688 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 40.6 ttp -106.28 177.7 4.78 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.853 1.661 . . . . 0.0 107.462 178.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -76.26 68.4 2.65 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 119.278 -2.139 . . . . 0.0 112.757 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.319 76.8 p 94.0 130.79 0.02 OUTLIER 'General case' 0 C--N 1.363 1.176 0 C-N-CA 131.448 3.899 . . . . 0.0 108.155 -171.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.7 p -158.79 37.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.126 0 CA-C-O 124.797 2.237 . . . . 0.0 106.477 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.261 8.5 t 98.03 -31.06 0.02 OUTLIER 'General case' 0 C--N 1.357 0.933 0 C-N-CA 130.855 3.662 . . . . 0.0 108.859 -171.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 165.77 13.87 Favored 'General case' 0 C--N 1.366 1.31 0 C-N-CA 126.593 1.957 . . . . 0.0 115.81 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -131.72 164.75 25.27 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.562 HG21 ' CD1' ' A' ' 99' ' ' TYR 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.404 ' HB2' HG12 ' A' ' 125' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 122' ' ' PRO 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.438 ' CG ' HG12 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -7.52 -47.85 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 4 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? -65.33 -4.9 6.07 Favored 'General case' 0 C--N 1.374 1.639 0 C-N-CA 127.994 2.517 . . . . 0.0 114.857 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 -24.69 41.83 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 129.172 2.989 . . . . 0.0 111.718 170.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 66.96 -47.28 0.47 Allowed 'General case' 0 C--N 1.369 1.421 0 C-N-CA 129.567 3.147 . . . . 0.0 117.512 177.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 . . . . . 0 C--N 1.358 0.966 0 C-N-CA 129.943 3.297 . . . . 0.0 113.467 -179.334 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -119.5 146.51 45.38 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 105.739 176.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.65 -40.65 51.83 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 128.996 2.919 . . . . 0.0 114.415 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -28.39 67.18 Favored 'General case' 0 C--N 1.365 1.243 0 C-N-CA 128.403 2.681 . . . . 0.0 113.572 175.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 59' ' ' MET 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.465 ' HE2' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.408 HG23 ' HH ' ' A' ' 99' ' ' TYR 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.452 ' HA ' HG21 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' A' ' 89' ' ' LEU 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.465 ' CE2' ' HE2' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -104.68 -54.42 2.51 Favored 'General case' 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.413 ' HA ' ' CA ' ' A' ' 107' ' ' GLY . . . -86.96 8.4 23.38 Favored 'General case' 0 C--N 1.377 1.783 0 O-C-N 119.849 -1.782 . . . . 0.0 115.703 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -82.98 -22.09 58.16 Favored Glycine 0 C--N 1.347 1.155 0 C-N-CA 126.693 2.092 . . . . 0.0 110.083 161.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.477 1.6 pt? -120.64 -53.08 2.11 Favored 'General case' 0 C--N 1.369 1.455 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 175.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -118.1 37.9 3.85 Favored 'General case' 0 CA--C 1.487 -1.448 0 C-N-CA 127.599 2.36 . . . . 0.0 106.807 -168.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.413 ' CA ' ' HA ' ' A' ' 103' ' ' ALA . . . -83.19 23.3 6.23 Favored Glycine 0 N--CA 1.432 -1.578 0 C-N-CA 127.329 2.395 . . . . 0.0 118.894 -167.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.5 mtm-85 65.64 -58.72 0.3 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 128.623 2.769 . . . . 0.0 117.9 170.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.0 t -88.58 -51.66 5.57 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 127.732 2.413 . . . . 0.0 108.543 173.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 4.7 ttt -164.82 -179.27 5.72 Favored 'General case' 0 C--N 1.362 1.126 0 CA-C-O 121.635 0.731 . . . . 0.0 109.062 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.21 89.28 4.71 Favored 'General case' 0 C--N 1.352 0.699 0 C-N-CA 130.599 3.559 . . . . 0.0 112.13 -179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.38 2.4 t 65.54 32.19 9.54 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 129.414 3.086 . . . . 0.0 117.209 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.3 t -127.75 -75.33 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.366 0 O-C-N 119.393 -2.067 . . . . 0.0 107.729 -176.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 12.6 p -88.27 35.41 0.76 Allowed 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.633 2.373 . . . . 0.0 110.739 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.02 61.72 4.71 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.806 2.042 . . . . 0.0 112.457 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -67.94 100.23 0.94 Allowed 'General case' 0 C--N 1.364 1.232 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -174.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . 0.499 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.534 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.514 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 6.4 tmm_? -105.24 -87.4 0.45 Allowed 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -82.61 76.73 9.45 Favored 'General case' 0 C--N 1.353 0.738 0 O-C-N 120.205 -1.56 . . . . 0.0 112.297 -178.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.77 -46.87 28.4 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 127.692 2.397 . . . . 0.0 112.55 177.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -173.2 -174.19 1.01 Allowed 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . 0.256 10.2 mpt_? . . . . . 0 C--N 1.364 1.233 0 C-N-CA 128.356 2.662 . . . . 0.0 113.265 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.742 HD13 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.742 ' H ' HD13 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 73' ' ' ASN 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' ALA 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.472 HD21 ' HG2' ' A' ' 68' ' ' LYS 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 73' ' ' ASN . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.695 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.695 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.454 ' HB1' HG22 ' A' ' 121' ' ' ILE . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.418 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.454 HG22 ' HB1' ' A' ' 95' ' ' ALA 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.418 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.458 HD13 ' H ' ' A' ' 125' ' ' ILE 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HG ' ' A' ' 56' ' ' LEU . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.549 HG13 HD23 ' A' ' 63' ' ' LEU 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.599 HD22 ' HB ' ' A' ' 121' ' ' ILE . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.597 HG21 HG13 ' A' ' 88' ' ' VAL . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.449 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 85' ' ' PRO . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 84' ' ' ILE . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 64' ' ' VAL . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.458 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.458 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.487 ' HB3' HG21 ' A' ' 60' ' ' VAL . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.449 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.434 -1.259 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.599 ' HB ' HD22 ' A' ' 63' ' ' LEU 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' ' 125' ' ' ILE . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.692 ' H ' HD12 ' A' ' 125' ' ' ILE 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 64' ' ' VAL . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 C--O 1.222 -0.376 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.5 m120 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.52 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 92' ' ' VAL 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.501 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.463 HG23 HG12 ' A' ' 60' ' ' VAL . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.432 ' O ' HG13 ' A' ' 92' ' ' VAL 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.591 HG23 HG22 ' A' ' 57' ' ' THR 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.499 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HB3' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 115.138 1.532 . . . . 0.0 115.138 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.4 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.558 HD13 ' H ' ' A' ' 125' ' ' ILE 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 . . . . . 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.49 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.49 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.67 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.448 ' H ' HD23 ' A' ' 56' ' ' LEU 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.705 HG13 HD23 ' A' ' 63' ' ' LEU 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 5 4 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.527 HG23 HG12 ' A' ' 60' ' ' VAL . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.455 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HB1' HD11 ' A' ' 129' ' ' LEU . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.501 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' VAL . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG23 ' A' ' 92' ' ' VAL 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 88' ' ' VAL . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.67 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER . . . . . 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.457 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.495 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 64' ' ' VAL . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.477 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--O 1.222 -0.373 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 96' ' ' ALA 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.441 HG22 HG12 ' A' ' 92' ' ' VAL 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.442 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.407 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 117' ' ' PHE . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' A' ' 129' ' ' LEU . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.442 ' HA ' HG11 ' A' ' 60' ' ' VAL . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.533 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 121' ' ' ILE . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 56' ' ' LEU 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.441 ' CG ' HG22 ' A' ' 121' ' ' ILE . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 . . . . . 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.412 ' HB2' ' HB2' ' A' ' 63' ' ' LEU . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.651 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.651 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.401 HG23 HD13 ' A' ' 125' ' ' ILE . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 124' ' ' THR 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.489 HD23 ' CE2' ' A' ' 91' ' ' PHE . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 41.6 ttp180 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.521 HG22 HG23 ' A' ' 92' ' ' VAL 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.446 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.564 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.42 HG23 ' H ' ' A' ' 88' ' ' VAL . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.521 HG23 HG22 ' A' ' 57' ' ' THR 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.472 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.289 30.9 t30 . . . . . 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.495 HD22 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.806 0 N-CA-C 116.785 2.143 . . . . 0.0 116.785 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.495 ' N ' HD22 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.576 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.443 ' CD ' HG22 ' A' ' 121' ' ' ILE . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.434 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.51 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 54' ' ' GLU . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.547 HD13 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.547 ' H ' HD13 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.467 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.566 HG12 ' CE2' ' A' ' 91' ' ' PHE 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.461 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 13.1 p-10 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 132' ' ' TYR 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' HG22 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE2' HG12 ' A' ' 64' ' ' VAL . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.588 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.481 ' HA ' HG23 ' A' ' 121' ' ' ILE . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.616 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.616 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.56 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.461 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 . . . . . 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER . . . . . 0 C--O 1.214 -0.792 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.654 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.422 ' N ' HD23 ' A' ' 56' ' ' LEU 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.62 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 62' ' ' LEU 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 133' ' ' ARG 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.4 HD22 ' HB3' ' A' ' 68' ' ' LYS 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 4 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.434 ' HA ' ' HB3' ' A' ' 91' ' ' PHE 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 88' ' ' VAL . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.62 HG12 ' HB ' ' A' ' 60' ' ' VAL 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.654 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.584 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.465 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.612 ' HG2' HD11 ' A' ' 125' ' ' ILE . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.612 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.496 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.418 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 25.5 ttt180 . . . . . 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp . . . . . 0 C--O 1.22 -0.461 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.726 HG23 ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.726 ' H ' HG23 ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 5 4 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.419 ' HG3' HD11 ' A' ' 84' ' ' ILE . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.419 HD11 ' HG3' ' A' ' 61' ' ' PRO . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CD ' HG21 ' A' ' 48' ' ' THR . 62.0 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.475 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 . . . . . 0 CA--C 1.505 -0.781 0 CA-C-O 122.995 1.379 . . . . 0.0 108.189 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.453 ' CZ ' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.644 HD13 ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? . . . . . 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.459 HG23 ' HB2' ' A' ' 52' ' ' HIS . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.459 ' HB2' HG23 ' A' ' 47' ' ' ILE . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 4 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.447 HD23 HG13 ' A' ' 60' ' ' VAL . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.45 ' HG2' ' HB2' ' A' ' 132' ' ' TYR 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.422 HD21 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.466 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.442 ' O ' HD13 ' A' ' 90' ' ' ILE . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.465 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.442 HD13 ' O ' ' A' ' 87' ' ' GLY 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.487 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.731 0 N-CA-C 116.404 2.001 . . . . 0.0 116.404 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.45 ' HB2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.415 ' HB2' ' HG3' ' A' ' 85' ' ' PRO . 6.2 tmm_? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.588 HG22 HG23 ' A' ' 92' ' ' VAL 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 61' ' ' PRO . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.641 HG21 ' HA ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 58' ' ' GLU 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' CE2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 121' ' ' ILE . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 129' ' ' LEU 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 92' ' ' VAL 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 125' ' ' ILE . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 88' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 . . . . . 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 . . . . . 0 C--O 1.233 0.228 0 N-CA-C 121.082 3.734 . . . . 0.0 121.082 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.531 ' CE2' HD12 ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.444 HG12 HD22 ' A' ' 63' ' ' LEU . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.449 HG22 ' CD1' ' A' ' 91' ' ' PHE 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 64' ' ' VAL . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.478 ' HB3' HG23 ' A' ' 88' ' ' VAL . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.428 ' H ' ' HB2' ' A' ' 132' ' ' TYR 0.332 9.3 ptm180 . . . . . 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE2' HD23 ' A' ' 129' ' ' LEU . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.644 ' HB1' ' HB2' ' A' ' 56' ' ' LEU 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.465 2.3 t-20 . . . . . 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.454 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.558 ' HG2' HD11 ' A' ' 125' ' ' ILE . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.558 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.506 HD23 ' CE2' ' A' ' 91' ' ' PHE . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 85' ' ' PRO . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 . . . . . 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 52' ' ' HIS . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 58.1 t30 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.413 ' HB2' HG22 ' A' ' 47' ' ' ILE . 57.5 m170 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 56' ' ' LEU 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.466 ' HA ' HG22 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE2' HD23 ' A' ' 129' ' ' LEU . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.492 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.607 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 91' ' ' PHE . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.406 ' HB3' ' HG ' ' A' ' 56' ' ' LEU . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER . . . . . 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.513 -0.47 0 CA-C-O 122.675 1.226 . . . . 0.0 107.788 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.537 HD11 ' HB1' ' A' ' 67' ' ' ALA . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 52' ' ' HIS . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.566 ' HB3' HG22 ' A' ' 47' ' ' ILE . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 HG23 ' A' ' 64' ' ' VAL 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.542 HG23 HG12 ' A' ' 60' ' ' VAL . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.432 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.432 HG13 ' CG ' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.407 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HG3' HD11 ' A' ' 47' ' ' ILE . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 47' ' ' ILE 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 . . . . . 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.192 1 N-CA-C 123.374 4.583 . . . . 0.0 123.374 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.6 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.6 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ARG . . . . . 0.507 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 . . . . . 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.573 ' O ' HG12 ' A' ' 60' ' ' VAL . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.678 HG13 ' HD3' ' A' ' 61' ' ' PRO 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.678 ' HD3' HG13 ' A' ' 60' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.426 HD23 HG23 ' A' ' 60' ' ' VAL . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 129' ' ' LEU . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 73' ' ' ASN . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.408 ' HB3' ' HG2' ' A' ' 68' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.429 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.506 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.0 p30 . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 129' ' ' LEU 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 67' ' ' ALA . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? . . . . . 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 93' ' ' ALA 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.525 HG22 HG23 ' A' ' 92' ' ' VAL 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HA ' ' HD2' ' A' ' 61' ' ' PRO 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 5 4 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' ' HA ' ' A' ' 58' ' ' GLU . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.489 ' HD1' ' H ' ' A' ' 83' ' ' SER 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 4 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.489 ' H ' ' HD1' ' A' ' 75' ' ' PHE . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.558 ' O ' HG13 ' A' ' 92' ' ' VAL 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.683 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.487 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.427 ' CD2' HG22 ' A' ' 121' ' ' ILE . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.5 t30 . . . . . 0 CA--C 1.511 -0.543 0 CA-C-O 123.812 1.768 . . . . 0.0 114.708 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.56 ' HB3' HD22 ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.479 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.479 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.378 0 N-CA-C 112.816 0.672 . . . . 0.0 112.816 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 6.1 m120 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.63 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.63 HG23 HD23 ' A' ' 56' ' ' LEU 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.574 HG13 HD23 ' A' ' 63' ' ' LEU 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 5 4 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.688 HD22 HD12 ' A' ' 121' ' ' ILE . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' LYS 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.448 ' HA ' ' CE2' ' A' ' 75' ' ' PHE 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' ASP 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 129' ' ' LEU . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.553 HG23 HG22 ' A' ' 57' ' ' THR 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.514 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 120' ' ' GLU . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.688 HD12 HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.413 ' CD2' ' HG3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 . . . . . 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm . . . . . 0 CA--C 1.511 -0.533 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.694 HG22 HG12 ' A' ' 92' ' ' VAL 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.516 ' CG1' HG22 ' A' ' 92' ' ' VAL 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 4 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 57' ' ' THR . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.442 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 . . . . . 0 CA--C 1.507 -0.695 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HD1' HD11 ' A' ' 121' ' ' ILE . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.409 HD11 ' HD1' ' A' ' 117' ' ' PHE 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.457 HG22 ' HD1' ' A' ' 91' ' ' PHE 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.465 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 52' ' ' HIS . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.45 ' HB2' HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.431 HG22 HG23 ' A' ' 92' ' ' VAL 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.605 ' CG1' HG12 ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 121' ' ' ILE . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.452 ' HG2' HG23 ' A' ' 88' ' ' VAL . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.603 HG11 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.605 HG12 ' CG1' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.563 ' CE1' HG23 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 . . . . . 0 CA--C 1.502 -0.868 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.797 HG22 ' HD2' ' A' ' 122' ' ' PRO 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.797 ' HD2' HG22 ' A' ' 121' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.603 ' CG ' HG11 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 3 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.4 ' O ' ' HD3' ' A' ' 61' ' ' PRO 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.508 ' HE3' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG1' HG12 ' A' ' 60' ' ' VAL 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.556 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 68' ' ' LYS 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.538 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.486 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.508 ' CE2' ' HE3' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.679 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.679 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' TYR . . . . . 0.556 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 . . . . . 0 N--CA 1.44 -0.928 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.287 84.3 mtm180 87.57 -19.67 0.23 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 129.659 3.183 . . . . 0.0 113.033 -178.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 t -63.11 -38.97 83.48 Favored 'Isoleucine or valine' 0 C--N 1.368 1.38 0 C-N-CA 129.009 2.924 . . . . 0.0 112.894 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -63.44 -27.55 69.36 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 129.91 3.284 . . . . 0.0 113.917 174.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.742 HD13 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.742 ' H ' HD13 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.499 ' HZ1' ' HA ' ' A' ' 135' ' ' MET 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' ALA 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.472 HD21 ' HG2' ' A' ' 68' ' ' LYS 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 73' ' ' ASN . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.695 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.695 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.454 ' HB1' HG22 ' A' ' 121' ' ' ILE . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.418 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.409 ' O ' HD21 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -95.1 -63.34 1.18 Allowed 'General case' 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.25 12.22 33.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.855 3.28 . . . . 0.0 119.855 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -80.23 -17.08 74.96 Favored Glycine 0 C--N 1.357 1.707 0 O-C-N 119.331 -2.106 . . . . 0.0 110.3 161.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.598 ' H ' HD23 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -117.46 -56.2 2.24 Favored 'General case' 0 CA--C 1.493 -1.235 0 C-N-CA 129.096 2.958 . . . . 0.0 117.026 -176.147 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 47.5 p -91.78 12.39 21.55 Favored 'General case' 0 C--N 1.355 0.827 0 CA-C-O 123.598 1.666 . . . . 0.0 111.028 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -64.33 3.93 Favored Glycine 0 C--N 1.35 1.317 1 C-N-CA 135.135 6.112 . . . . 0.0 119.939 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.259 53.2 ttt180 87.15 -10.87 0.58 Allowed 'General case' 0 C--N 1.36 1.064 0 C-N-CA 129.188 2.995 . . . . 0.0 115.561 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.4 m -110.63 31.31 6.07 Favored 'General case' 0 C--N 1.362 1.116 0 O-C-N 119.908 -1.745 . . . . 0.0 113.999 -177.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.275 12.9 tpt 80.52 145.99 0.08 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.69 2.796 . . . . 0.0 117.476 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -87.83 20.09 3.21 Favored 'General case' 0 C--N 1.368 1.381 0 C-N-CA 129.259 3.024 . . . . 0.0 116.487 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 27.7 m 165.69 115.74 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.901 3.28 . . . . 0.0 104.012 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.446 HG22 ' H ' ' A' ' 114' ' ' SER . 9.5 p -156.81 -176.63 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.446 ' H ' HG22 ' A' ' 113' ' ' VAL . 18.1 m -74.16 61.31 0.84 Allowed 'General case' 0 C--N 1.368 1.409 0 C-N-CA 129.549 3.14 . . . . 0.0 109.925 172.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.357 22.9 m-85 -22.53 137.07 0.01 OUTLIER 'General case' 0 C--N 1.357 0.909 2 N-CA-C 127.217 6.006 . . . . 0.0 127.217 -166.396 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -5.52 46.23 Favored 'General case' 0 C--N 1.36 1.039 1 C-N-CA 134.361 5.064 . . . . 0.0 116.437 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.454 HG22 ' HB1' ' A' ' 95' ' ' ALA 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.418 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.458 HD13 ' H ' ' A' ' 125' ' ' ILE 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -148.52 153.7 38.78 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 5.2 mmtp 68.36 -55.66 0.51 Allowed 'General case' 0 C--N 1.354 0.788 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.499 ' HA ' ' HZ1' ' A' ' 68' ' ' LYS 0.347 1.8 mpt? 68.73 -30.5 0.18 Allowed 'General case' 0 C--N 1.359 1.021 0 C-N-CA 131.401 3.88 . . . . 0.0 116.18 177.421 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -167.28 -176.11 3.16 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 127.754 2.422 . . . . 0.0 105.161 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 174.624 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.5 tp60 . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 83.8 107.84 0.06 Allowed 'General case' 0 C--N 1.363 1.185 0 C-N-CA 129.654 3.182 . . . . 0.0 110.811 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 41' ' ' VAL . 2.5 t -53.63 -44.93 59.29 Favored 'Isoleucine or valine' 0 C--N 1.369 1.454 0 C-N-CA 128.96 2.904 . . . . 0.0 116.959 -171.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER -68.66 -26.13 65.16 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.083 2.553 . . . . 0.0 115.609 172.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HG ' ' A' ' 56' ' ' LEU . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.549 HG13 HD23 ' A' ' 63' ' ' LEU 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.599 HD22 ' HB ' ' A' ' 121' ' ' ILE . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.597 HG21 HG13 ' A' ' 88' ' ' VAL . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.449 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 85' ' ' PRO . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 84' ' ' ILE . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 64' ' ' VAL . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.458 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.458 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.487 ' HB3' HG21 ' A' ' 60' ' ' VAL . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.449 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.14 5.66 24.16 Favored 'General case' 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.17 12.11 34.24 Favored 'General case' 0 C--N 1.373 1.596 0 CA-C-N 122.036 2.198 . . . . 0.0 114.687 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.93 -11.89 69.44 Favored Glycine 0 C--N 1.36 1.903 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 158.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.372 2.5 pp -117.81 -56.62 2.18 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 117.776 2.51 . . . . 0.0 117.776 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 m -92.28 38.71 1.01 Allowed 'General case' 0 C--N 1.36 1.054 0 C-N-CA 128.678 2.791 . . . . 0.0 107.048 177.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.74 -179.73 30.56 Favored Glycine 0 C--N 1.355 1.61 0 C-N-CA 126.552 2.025 . . . . 0.0 113.646 -161.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -165.51 176.86 7.83 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 119.624 -2.103 . . . . 0.0 105.964 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -72.38 70.98 0.9 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.452 2.301 . . . . 0.0 114.057 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.254 26.4 mmt 104.87 -77.12 0.0 OUTLIER 'General case' 0 C--N 1.357 0.935 0 C-N-CA 131.537 3.935 . . . . 0.0 109.824 -178.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.254 34.3 t70 98.03 71.98 0.0 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 128.699 2.8 . . . . 0.0 107.543 -169.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.324 75.3 m 75.05 -48.93 0.65 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.788 2.835 . . . . 0.0 115.434 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.492 0.5 OUTLIER 106.63 -39.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 130.765 3.626 . . . . 0.0 110.786 178.409 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.1 m -85.2 -11.38 55.08 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 125.686 1.594 . . . . 0.0 112.1 170.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 54.78 -98.82 0.09 Allowed 'General case' 0 C--N 1.372 1.545 0 C-N-CA 130.412 3.485 . . . . 0.0 118.562 175.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -179.38 22.36 0.0 OUTLIER 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.424 -1.716 . . . . 0.0 108.658 -164.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.599 ' HB ' HD22 ' A' ' 63' ' ' LEU 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' ' 125' ' ' ILE . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.692 ' H ' HD12 ' A' ' 125' ' ' ILE 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 64' ' ' VAL . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 74.87 -69.12 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -171.72 35.18 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 174.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.0 ppp? -68.09 -19.24 64.84 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.102 2.26 . . . . 0.0 117.102 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -120.89 115.43 23.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 126.784 2.034 . . . . 0.0 108.178 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 . . . . . 0 C--N 1.359 1.018 0 C-N-CA 125.274 1.43 . . . . 0.0 112.265 -178.622 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.947 0 CA-C-O 121.955 0.883 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -115.36 125.04 52.72 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 126.301 1.84 . . . . 0.0 106.282 177.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.25 27.6 m -61.92 -34.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 C-N-CA 128.244 2.618 . . . . 0.0 115.551 -178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -67.98 -28.18 67.22 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.791 2.436 . . . . 0.0 113.077 172.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.5 m120 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.52 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 92' ' ' VAL 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.501 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.463 HG23 HG12 ' A' ' 60' ' ' VAL . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.432 ' O ' HG13 ' A' ' 92' ' ' VAL 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.591 HG23 HG22 ' A' ' 57' ' ' THR 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.499 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HB3' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 162.77 60.5 0.0 OUTLIER 'General case' 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.98 26.5 9.18 Favored 'General case' 0 C--N 1.37 1.464 0 O-C-N 119.606 -1.934 . . . . 0.0 112.353 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 101.65 20.75 12.42 Favored Glycine 0 C--N 1.365 2.144 0 O-C-N 120.964 -1.085 . . . . 0.0 113.904 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 105' ' ' LEU . 2.4 pt? -88.43 -59.24 2.29 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.364 1.865 . . . . 0.0 112.14 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.467 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 4.1 m -86.73 7.55 26.28 Favored 'General case' 0 C--N 1.381 1.953 0 C-N-CA 129.209 3.003 . . . . 0.0 108.932 176.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.97 -5.78 52.95 Favored Glycine 0 N--CA 1.416 -2.644 1 C-N-CA 130.806 4.05 . . . . 0.0 113.683 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.9 ttt-85 -168.23 -39.62 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 CA-C-N 120.318 2.059 . . . . 0.0 112.186 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.5 m -112.32 -176.29 2.88 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 125.124 1.37 . . . . 0.0 107.862 -178.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 11.2 ttm -106.97 -129.41 0.28 Allowed 'General case' 0 C--N 1.358 0.944 0 O-C-N 120.375 -1.453 . . . . 0.0 114.257 -174.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.38 79.99 1.4 Allowed 'General case' 0 C--N 1.358 0.967 0 C-N-CA 127.033 2.133 . . . . 0.0 110.579 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.343 75.3 p 77.61 55.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 127.138 2.175 . . . . 0.0 114.531 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.23 66.26 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 103.164 -2.902 . . . . 0.0 103.164 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.3 67.1 m 62.41 -48.02 0.18 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 130.21 3.404 . . . . 0.0 115.575 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 74.95 -92.06 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.483 3.113 . . . . 0.0 113.861 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -173.31 14.05 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 112.414 -2.175 . . . . 0.0 115.138 -166.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.4 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.558 HD13 ' H ' ' A' ' 125' ' ' ILE 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 -102.85 155.69 18.17 Favored 'General case' 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.368 42.4 mmtm 75.97 32.92 0.62 Allowed 'General case' 0 C--N 1.353 0.742 0 C-N-CA 127.032 2.133 . . . . 0.0 116.459 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 89.0 mtp -76.28 -19.84 57.92 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 127.347 2.259 . . . . 0.0 113.089 174.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -99.49 -36.0 9.7 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 126.09 1.756 . . . . 0.0 114.583 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--N 1.362 1.124 0 O-C-N 120.702 -1.249 . . . . 0.0 111.601 -176.115 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -108.85 117.09 33.28 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.9 t -55.37 -35.5 37.27 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 129.531 3.132 . . . . 0.0 115.224 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.3 -27.64 66.48 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.785 2.834 . . . . 0.0 113.095 172.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.49 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.49 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.67 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.448 ' H ' HD23 ' A' ' 56' ' ' LEU 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.705 HG13 HD23 ' A' ' 63' ' ' LEU 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.527 HG23 HG12 ' A' ' 60' ' ' VAL . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.455 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HB1' HD11 ' A' ' 129' ' ' LEU . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.501 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' VAL . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG23 ' A' ' 92' ' ' VAL 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 88' ' ' VAL . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.67 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER -104.62 8.28 35.23 Favored 'General case' 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.25 22.45 12.42 Favored 'General case' 0 C--N 1.37 1.477 0 O-C-N 118.827 -2.42 . . . . 0.0 115.828 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.76 -12.7 63.85 Favored Glycine 0 C--N 1.356 1.681 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 153.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.373 4.0 pp -117.96 -53.75 2.36 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 118.643 2.831 . . . . 0.0 118.643 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -102.32 37.94 1.79 Allowed 'General case' 0 C--N 1.363 1.183 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.16 -177.9 50.83 Favored Glycine 0 C--N 1.352 1.472 0 C-N-CA 129.794 3.568 . . . . 0.0 114.633 -172.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.57 157.62 39.99 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -91.61 56.2 2.94 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 125.47 1.508 . . . . 0.0 110.185 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.256 65.9 mtt 72.42 -37.89 0.4 Allowed 'General case' 0 C--N 1.358 0.941 0 C-N-CA 130.14 3.376 . . . . 0.0 113.921 -173.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 80.51 -90.76 0.02 OUTLIER 'General case' 0 C--N 1.362 1.148 0 C-N-CA 130.41 3.484 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.1 t -122.16 6.02 9.74 Favored 'General case' 0 C--N 1.349 0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.453 0.3 OUTLIER 92.87 -34.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.373 0 C-N-CA 129.466 3.106 . . . . 0.0 112.43 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 74.9 m -102.46 85.6 2.64 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 127.231 2.213 . . . . 0.0 105.641 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.314 0.1 OUTLIER -74.3 -66.0 0.78 Allowed 'General case' 0 C--N 1.367 1.366 0 N-CA-C 119.059 2.985 . . . . 0.0 119.059 -169.624 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.02 58.36 0.03 OUTLIER 'General case' 0 C--N 1.362 1.138 0 O-C-N 120.328 -1.483 . . . . 0.0 113.71 -170.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.457 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.495 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 64' ' ' VAL . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.477 0.0 OUTLIER 79.45 -55.11 0.42 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.335 10.0 pttt 123.92 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.353 0.755 1 C-N-CA 132.675 4.39 . . . . 0.0 109.069 173.231 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 12.4 ptp 46.3 -45.62 0.0 OUTLIER 'General case' 0 C--N 1.359 1.001 2 N-CA-C 122.539 4.274 . . . . 0.0 122.539 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 84.91 6.4 0.51 Allowed 'General case' 0 C--N 1.361 1.103 0 C-N-CA 129.664 3.186 . . . . 0.0 111.947 -173.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 . . . . . 0 C--N 1.361 1.071 0 C-N-CA 126.221 1.808 . . . . 0.0 111.137 -176.988 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 . . . . . 0 N--CA 1.441 -0.896 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -85.84 -12.42 50.83 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 126.9 2.08 . . . . 0.0 116.029 -174.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.33 -40.71 78.12 Favored 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 126.186 1.794 . . . . 0.0 112.619 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -68.68 -28.94 67.31 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 126.862 2.065 . . . . 0.0 115.196 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 96' ' ' ALA 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.441 HG22 HG12 ' A' ' 92' ' ' VAL 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.442 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.407 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 117' ' ' PHE . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' A' ' 129' ' ' LEU . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.442 ' HA ' HG11 ' A' ' 60' ' ' VAL . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.533 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 121' ' ' ILE . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 56' ' ' LEU 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.441 ' CG ' HG22 ' A' ' 121' ' ' ILE . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -142.54 56.5 1.43 Allowed 'General case' 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -98.68 -29.65 12.9 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 125.445 1.498 . . . . 0.0 112.26 176.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 157.23 62.67 0.01 OUTLIER Glycine 0 CA--C 1.487 -1.692 0 N-CA-C 108.171 -1.972 . . . . 0.0 108.171 -166.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.822 HD12 ' H ' ' A' ' 106' ' ' THR . 0.4 OUTLIER -117.46 -73.06 0.66 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.363 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.822 ' H ' HD12 ' A' ' 105' ' ' LEU . 6.0 p -128.99 37.0 4.13 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 130.061 3.344 . . . . 0.0 111.016 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.41 -58.54 1.64 Allowed Glycine 0 C--N 1.361 1.944 0 C-N-CA 125.622 1.582 . . . . 0.0 114.556 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 156.68 -40.02 0.01 OUTLIER 'General case' 0 C--N 1.356 0.864 0 C-N-CA 127.858 2.463 . . . . 0.0 105.206 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.9 t -75.95 163.31 27.31 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.141 2.576 . . . . 0.0 112.68 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' MET . . . . . 0.499 ' HG3' ' H ' ' A' ' 111' ' ' ASP . 14.0 tpp -99.83 -160.74 0.82 Allowed 'General case' 0 C--N 1.355 0.841 0 C-N-CA 125.936 1.694 . . . . 0.0 112.267 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.499 ' H ' ' HG3' ' A' ' 110' ' ' MET . 1.2 p30 -88.85 154.23 20.42 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 128.911 2.884 . . . . 0.0 108.154 171.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 14.1 t -20.77 92.63 0.01 OUTLIER 'General case' 0 C--N 1.37 1.499 1 C-N-CA 132.808 4.443 . . . . 0.0 116.748 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.4 t -150.24 -70.3 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.283 0 N-CA-C 103.923 -2.621 . . . . 0.0 103.923 -165.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.4 t -102.13 38.61 1.63 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.36 55.3 p90 -161.13 141.21 10.89 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -125.15 140.84 52.51 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 174.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.412 ' HB2' ' HB2' ' A' ' 63' ' ' LEU . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.651 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.651 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.401 HG23 HD13 ' A' ' 125' ' ' ILE . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 124' ' ' THR 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.489 HD23 ' CE2' ' A' ' 91' ' ' PHE . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.606 ' HG2' ' H ' ' A' ' 134' ' ' LYS . 41.6 ttp180 -158.85 -147.0 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.606 ' H ' ' HG2' ' A' ' 133' ' ' ARG 0.281 7.2 tttt 3.22 0.83 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 2 C-N-CA 139.916 7.287 . . . . 0.0 126.923 177.493 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 23.9 ptp -19.26 18.12 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 2 C-N-CA 138.027 6.531 . . . . 0.0 124.64 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -78.99 67.13 4.61 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 126.875 2.07 . . . . 0.0 114.918 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 . . . . . 0 C--N 1.358 0.937 0 C-N-CA 126.247 1.819 . . . . 0.0 111.7 177.487 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 . . . . . 0 N--CA 1.444 -0.75 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 76.4 mtm180 -84.31 -47.84 10.34 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.537 1.935 . . . . 0.0 113.381 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.7 t -58.76 -34.8 53.04 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 C-N-CA 129.833 3.253 . . . . 0.0 115.362 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -68.21 -27.56 66.49 Favored 'General case' 0 C--N 1.367 1.361 0 C-N-CA 126.921 2.088 . . . . 0.0 114.516 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.521 HG22 HG23 ' A' ' 92' ' ' VAL 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.446 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.564 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.42 HG23 ' H ' ' A' ' 88' ' ' VAL . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.521 HG23 HG22 ' A' ' 57' ' ' THR 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.472 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.289 30.9 t30 -174.11 85.22 0.04 OUTLIER 'General case' 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -48.8 -47.38 42.18 Favored 'General case' 0 C--N 1.375 1.704 0 C-N-CA 128.042 2.537 . . . . 0.0 116.566 173.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.23 -46.88 0.05 OUTLIER Glycine 0 CA--C 1.479 -2.212 0 C-N-CA 119.123 -1.513 . . . . 0.0 110.341 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.359 1.3 pt? -118.11 -75.66 0.58 Allowed 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -175.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 p -112.0 17.84 19.3 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 111.585 -168.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 85.14 0.19 Allowed Glycine 0 CA--C 1.54 1.627 0 C-N-CA 130.597 3.951 . . . . 0.0 117.243 -174.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 179.77 -59.56 0.01 OUTLIER 'General case' 0 C--N 1.378 1.83 0 C-N-CA 127.741 2.416 . . . . 0.0 105.252 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.0 m -88.18 168.77 12.47 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.514 2.326 . . . . 0.0 111.626 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 21.7 mmt -90.87 98.55 11.84 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 120.216 -1.553 . . . . 0.0 113.395 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -107.86 24.8 12.39 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.506 1.922 . . . . 0.0 109.87 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.6 t 172.6 -160.26 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.611 1 N-CA-C 99.514 -4.254 . . . . 0.0 99.514 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.264 1.9 p 176.82 -18.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.617 1.967 . . . . 0.0 106.822 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 10.6 t -77.18 58.18 1.54 Allowed 'General case' 0 C--N 1.368 1.37 0 C-N-CA 128.509 2.724 . . . . 0.0 109.797 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -36.96 148.52 0.03 OUTLIER 'General case' 0 C--N 1.365 1.25 2 C-N-CA 135.772 5.629 . . . . 0.0 123.585 -169.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.495 HD22 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -94.6 -9.69 34.28 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.677 3.191 . . . . 0.0 116.785 -173.457 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.495 ' N ' HD22 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.576 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.443 ' CD ' HG22 ' A' ' 121' ' ' ILE . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.434 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.51 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 135' ' ' MET . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER 70.88 -43.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -171.77 -35.52 0.02 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.031 -2.951 . . . . 0.0 103.031 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.421 ' HB2' ' CD1' ' A' ' 132' ' ' TYR . 1.9 ttt 60.1 -48.8 0.09 Allowed 'General case' 0 C--N 1.35 0.63 1 C-N-CA 131.89 4.076 . . . . 0.0 117.019 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -166.47 -44.49 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 125.309 1.443 . . . . 0.0 109.048 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.358 0.967 0 C-N-CA 125.26 1.424 . . . . 0.0 113.096 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 . . . . . 0 N--CA 1.441 -0.904 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -85.11 -18.45 34.21 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.495 2.318 . . . . 0.0 114.232 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 p -72.44 -38.82 61.45 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 C-N-CA 128.149 2.579 . . . . 0.0 113.852 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -67.93 -27.61 66.78 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 127.324 2.249 . . . . 0.0 114.969 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 54' ' ' GLU . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.547 HD13 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.547 ' H ' HD13 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.467 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.566 HG12 ' CE2' ' A' ' 91' ' ' PHE 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.461 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 13.1 p-10 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 132' ' ' TYR 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' HG22 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE2' HG12 ' A' ' 64' ' ' VAL . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.588 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.422 ' HA ' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.76 58.58 0.74 Allowed 'General case' 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 100' ' ' MET . . . -92.32 -78.72 0.4 Allowed 'General case' 0 C--N 1.353 0.727 0 O-C-N 121.359 -0.838 . . . . 0.0 111.956 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.14 11.94 6.11 Favored Glycine 0 C--N 1.354 1.578 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.732 HD12 ' H ' ' A' ' 106' ' ' THR . 0.5 OUTLIER -103.1 -55.49 2.4 Favored 'General case' 0 C--N 1.35 0.607 0 C-N-CA 126.132 1.773 . . . . 0.0 108.516 -179.131 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.732 ' H ' HD12 ' A' ' 105' ' ' LEU . 14.9 t -128.63 31.87 4.91 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.12 -40.73 23.92 Favored Glycine 0 C--N 1.361 1.948 0 C-N-CA 127.707 2.575 . . . . 0.0 114.354 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -168.0 -64.55 0.03 OUTLIER 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 101.032 -3.692 . . . . 0.0 101.032 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 m 153.95 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 131.33 3.852 . . . . 0.0 101.03 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' MET . . . . . 0.43 ' HB3' HG11 ' A' ' 113' ' ' VAL . 2.0 mpt? -81.97 99.27 9.01 Favored 'General case' 0 C--N 1.362 1.142 0 O-C-N 120.734 -1.229 . . . . 0.0 112.442 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -128.68 119.13 24.08 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.363 63.6 p 80.75 42.44 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 126.36 1.864 . . . . 0.0 113.265 -179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 110' ' ' MET . 6.9 p -105.83 -18.74 6.89 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 C-N-CA 127.343 2.257 . . . . 0.0 114.676 -175.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.256 76.0 p 101.86 -92.42 0.0 OUTLIER 'General case' 0 C--N 1.371 1.508 1 N-CA-C 99.591 -4.226 . . . . 0.0 99.591 -167.178 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.327 1.5 t80 -165.89 143.25 5.5 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 155.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -60.33 -5.56 1.18 Allowed 'General case' 0 C--N 1.351 0.668 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 -168.734 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.481 ' HA ' HG23 ' A' ' 121' ' ' ILE . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.616 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.616 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.56 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.461 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 -120.05 -2.71 10.19 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.467 ' HB3' ' CE1' ' A' ' 132' ' ' TYR . 0.5 OUTLIER -82.93 -37.45 24.14 Favored 'General case' 0 C--N 1.358 0.966 0 O-C-N 119.125 -2.235 . . . . 0.0 113.656 -177.707 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 5.6 ttt -36.46 39.93 0.0 OUTLIER 'General case' 0 C--N 1.363 1.171 2 C-N-CA 135.38 5.472 . . . . 0.0 122.159 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -88.34 68.7 8.97 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 119.236 -2.165 . . . . 0.0 111.265 176.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 . . . . . 0 C--N 1.359 0.983 0 C-N-CA 125.708 1.603 . . . . 0.0 111.26 -176.204 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.312 37.9 mmt180 95.23 -35.38 0.02 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.129 3.371 . . . . 0.0 113.748 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -62.61 -45.39 98.93 Favored 'Isoleucine or valine' 0 C--N 1.367 1.327 0 C-N-CA 126.522 1.929 . . . . 0.0 115.554 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER -68.85 -28.74 66.99 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 174.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.654 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.422 ' N ' HD23 ' A' ' 56' ' ' LEU 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.62 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 62' ' ' LEU 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 133' ' ' ARG 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.4 HD22 ' HB3' ' A' ' 68' ' ' LYS 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.434 ' HA ' ' HB3' ' A' ' 91' ' ' PHE 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 88' ' ' VAL . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.62 HG12 ' HB ' ' A' ' 60' ' ' VAL 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.654 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.584 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.465 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -20.77 66.55 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.1 13.19 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 119.966 -1.709 . . . . 0.0 115.149 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -87.46 -9.32 72.64 Favored Glycine 0 C--N 1.361 1.939 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 158.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.394 4.3 pp -118.19 -50.29 2.47 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 117.74 2.496 . . . . 0.0 117.74 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -102.34 32.81 3.37 Favored 'General case' 0 C--N 1.365 1.251 0 CA-C-O 124.032 1.872 . . . . 0.0 106.801 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.35 54.54 0.45 Allowed Glycine 0 CA--C 1.538 1.528 1 C-N-CA 131.837 4.541 . . . . 0.0 117.113 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -103.71 69.79 0.99 Allowed 'General case' 0 C--N 1.366 1.292 0 C-N-CA 128.098 2.559 . . . . 0.0 108.04 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.339 60.2 p 87.41 -112.94 0.01 OUTLIER 'General case' 0 C--N 1.35 0.607 0 C-N-CA 128.151 2.58 . . . . 0.0 110.37 -173.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.3 ptp -139.92 39.65 1.98 Allowed 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -49.69 -52.14 33.29 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 128.22 2.608 . . . . 0.0 116.549 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 2.0 p -118.14 52.85 0.99 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 127.851 2.46 . . . . 0.0 107.76 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.1 t -140.79 -49.74 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -176.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.5 t -90.56 31.63 1.02 Allowed 'General case' 0 C--N 1.369 1.45 0 O-C-N 119.938 -1.726 . . . . 0.0 110.072 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.07 -159.97 0.29 Allowed 'General case' 0 C--N 1.361 1.099 0 C-N-CA 130.26 3.424 . . . . 0.0 115.295 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.68 130.81 13.52 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 119.408 -2.058 . . . . 0.0 115.62 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.612 ' HG2' HD11 ' A' ' 125' ' ' ILE . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.612 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.496 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.418 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 25.5 ttt180 166.75 -156.33 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.98 -5.89 56.53 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 127.861 2.464 . . . . 0.0 111.849 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 45.8 mtt 64.65 -43.04 0.3 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.78 3.232 . . . . 0.0 116.168 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 71.55 -54.01 0.68 Allowed 'General case' 0 C--N 1.362 1.14 0 C-N-CA 130.123 3.369 . . . . 0.0 115.383 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 C--N 1.353 0.754 0 C-N-CA 126.46 1.904 . . . . 0.0 109.398 179.046 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 . . . . . 0 N--CA 1.437 -1.105 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 81.66 93.68 0.04 OUTLIER 'General case' 0 C--N 1.364 1.216 0 C-N-CA 127.859 2.464 . . . . 0.0 113.234 177.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.6 m -54.17 -33.82 25.85 Favored 'Isoleucine or valine' 0 C--N 1.37 1.481 0 C-N-CA 129.187 2.995 . . . . 0.0 114.974 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -66.33 -27.34 67.82 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.57 2.748 . . . . 0.0 113.852 173.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.726 HG23 ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.726 ' H ' HG23 ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.419 ' HG3' HD11 ' A' ' 84' ' ' ILE . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.419 HD11 ' HG3' ' A' ' 61' ' ' PRO . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CD ' HG21 ' A' ' 48' ' ' THR . 62.0 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.475 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -94.91 -48.62 5.93 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.437 ' HB1' ' HA3' ' A' ' 107' ' ' GLY 0.387 . . -49.69 37.68 0.0 OUTLIER 'General case' 0 C--N 1.366 1.3 1 N-CA-C 123.092 4.478 . . . . 0.0 123.092 -174.666 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -95.67 11.75 68.06 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 118.531 -2.606 . . . . 0.0 110.797 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.503 ' HG ' ' N ' ' A' ' 106' ' ' THR . 2.6 pt? -117.86 -65.52 1.17 Allowed 'General case' 0 CA--C 1.501 -0.908 0 C-N-CA 127.81 2.444 . . . . 0.0 112.932 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.503 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 13.1 t -82.51 -37.65 24.95 Favored 'General case' 0 CA--C 1.495 -1.145 0 C-N-CA 129.45 3.1 . . . . 0.0 107.806 -175.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.437 ' HA3' ' HB1' ' A' ' 103' ' ' ALA . . . -76.73 32.61 1.44 Allowed Glycine 0 C--N 1.362 2.022 0 N-CA-C 117.818 1.887 . . . . 0.0 117.818 175.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -148.22 138.1 22.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 120.169 -1.783 . . . . 0.0 109.456 -169.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.355 60.4 p 88.23 -12.74 0.44 Allowed 'General case' 0 C--N 1.362 1.142 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 39.8 mtt 77.78 58.09 0.03 OUTLIER 'General case' 0 C--N 1.358 0.968 0 C-N-CA 127.15 2.18 . . . . 0.0 113.594 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -89.77 65.94 6.93 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 126.366 1.866 . . . . 0.0 110.775 178.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.2 m 135.4 -63.73 0.0 OUTLIER 'General case' 0 C--N 1.358 0.956 0 C-N-CA 130.654 3.582 . . . . 0.0 105.121 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.418 0.4 OUTLIER 113.06 -21.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 130.548 3.539 . . . . 0.0 110.916 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.423 ' HA ' ' CE2' ' A' ' 117' ' ' PHE . 66.8 m -116.39 36.15 4.23 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.036 1.735 . . . . 0.0 110.697 179.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -52.64 14.22 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 1 C-N-CA 133.225 4.61 . . . . 0.0 119.9 -175.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 -153.04 -44.27 0.1 Allowed 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 126.625 1.97 . . . . 0.0 108.189 -170.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.453 ' CZ ' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.644 HD13 ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -102.25 112.54 25.27 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.257 11.8 tmtt? 136.06 -66.56 0.0 OUTLIER 'General case' 0 C--N 1.363 1.194 0 C-N-CA 128.208 2.603 . . . . 0.0 105.329 -178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 64.6 mtt 71.86 -43.89 0.58 Allowed 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.072 2.949 . . . . 0.0 114.949 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . 0.275 . . 97.99 -133.39 0.0 OUTLIER 'General case' 0 C--N 1.358 0.937 0 C-N-CA 130.732 3.613 . . . . 0.0 111.797 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 . . . . . 0 C--N 1.353 0.727 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -178.341 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.785 HE21 ' N ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.971 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -120.69 142.25 49.66 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.414 1.886 . . . . 0.0 107.608 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.07 -34.1 61.7 Favored 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 130.306 3.443 . . . . 0.0 113.558 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -67.94 -27.87 66.99 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 128.362 2.665 . . . . 0.0 114.291 174.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.459 HG23 ' HB2' ' A' ' 52' ' ' HIS . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.459 ' HB2' HG23 ' A' ' 47' ' ' ILE . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.447 HD23 HG13 ' A' ' 60' ' ' VAL . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.45 ' HG2' ' HB2' ' A' ' 132' ' ' TYR 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.422 HD21 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.466 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.442 ' O ' HD13 ' A' ' 90' ' ' ILE . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.465 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.442 HD13 ' O ' ' A' ' 87' ' ' GLY 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.487 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.7 -55.3 1.72 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.96 11.68 22.05 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 117.721 2.489 . . . . 0.0 117.721 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.35 -11.09 72.81 Favored Glycine 0 C--N 1.355 1.6 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 155.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.438 4.5 pp -118.8 -50.52 2.4 Favored 'General case' 0 C--N 1.368 1.392 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.8 t -114.58 37.62 3.35 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.752 2.021 . . . . 0.0 105.758 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.79 -43.56 27.9 Favored Glycine 0 C--N 1.359 1.822 0 C-N-CA 127.313 2.387 . . . . 0.0 116.184 -169.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.324 77.5 mtp180 89.9 39.66 0.01 OUTLIER 'General case' 0 C--N 1.364 1.238 0 C-N-CA 127.104 2.161 . . . . 0.0 112.779 169.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.2 t -175.56 172.09 2.67 Favored 'General case' 0 N--CA 1.442 -0.871 1 N-CA-C 98.883 -4.488 . . . . 0.0 98.883 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 36.6 ttm -92.37 -115.78 0.09 Allowed 'General case' 0 C--N 1.362 1.117 0 CA-C-N 119.978 1.263 . . . . 0.0 113.151 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -90.06 -71.2 0.63 Allowed 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.614 1.565 . . . . 0.0 112.07 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.291 10.3 t -148.4 80.23 1.45 Allowed 'General case' 0 C--N 1.349 0.571 0 N-CA-C 104.253 -2.499 . . . . 0.0 104.253 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.7 t -113.99 -86.01 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.6 t -115.83 82.62 1.8 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.432 ' CD2' ' CE2' ' A' ' 117' ' ' PHE . 0.4 OUTLIER -93.12 154.79 17.88 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 119.726 3.232 . . . . 0.0 119.726 -171.631 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -94.49 -4.61 47.82 Favored 'General case' 0 C--N 1.354 0.791 0 C-N-CA 130.78 3.632 . . . . 0.0 116.404 -173.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 115' ' ' TYR . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.45 ' HB2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.415 ' HB2' ' HG3' ' A' ' 85' ' ' PRO . 6.2 tmm_? 62.33 -78.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -77.42 51.68 0.89 Allowed 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.311 2.644 . . . . 0.0 114.781 -172.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 11.2 tpt -65.52 51.89 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 130.549 3.54 . . . . 0.0 116.144 -177.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -107.02 -4.29 19.15 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 119.652 -1.905 . . . . 0.0 110.989 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 . . . . . 0 C--N 1.356 0.865 0 C-N-CA 125.551 1.54 . . . . 0.0 107.454 -177.492 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -117.87 127.88 54.29 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 103.972 -2.603 . . . . 0.0 103.972 176.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.3 t -55.66 -43.76 74.41 Favored 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.121 2.568 . . . . 0.0 116.011 -174.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? -68.05 -28.02 67.02 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 126.266 1.826 . . . . 0.0 114.218 174.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.588 HG22 HG23 ' A' ' 92' ' ' VAL 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 61' ' ' PRO . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG21 ' HA ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 58' ' ' GLU 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' CE2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 121' ' ' ILE . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 129' ' ' LEU 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 92' ' ' VAL 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 125' ' ' ILE . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 88' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 106.16 81.78 0.0 OUTLIER 'General case' 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.12 71.04 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 126.454 1.902 . . . . 0.0 114.426 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 158.96 -22.87 0.31 Allowed Glycine 0 CA--C 1.487 -1.663 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.641 167.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.287 0.2 OUTLIER -117.76 -81.28 0.62 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.165 0.983 . . . . 0.0 113.338 -176.507 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.5 p -115.81 31.2 6.86 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.119 1.768 . . . . 0.0 111.363 -168.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.58 92.22 1.79 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 129.611 3.481 . . . . 0.0 109.744 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.256 29.5 mmt180 120.13 -32.02 0.01 OUTLIER 'General case' 0 C--N 1.38 1.93 0 C-N-CA 128.607 2.763 . . . . 0.0 105.391 -170.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.3 m -76.11 62.44 1.69 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.558 1.943 . . . . 0.0 115.96 -174.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 9.8 mmt -92.55 85.97 5.47 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 126.575 1.95 . . . . 0.0 111.591 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.5 63.31 0.61 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 126.546 1.938 . . . . 0.0 108.568 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 52.4 m -178.48 -74.74 0.01 OUTLIER 'General case' 0 C--N 1.35 0.595 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.603 0.3 OUTLIER 80.67 37.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.358 0.96 0 CA-C-O 126.201 2.905 . . . . 0.0 114.992 177.262 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 71.0 m -158.65 54.8 0.43 Allowed 'General case' 0 CA--C 1.515 -0.376 1 N-CA-C 100.038 -4.06 . . . . 0.0 100.038 173.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.388 0.8 OUTLIER -93.5 161.21 14.46 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 -163.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -67.94 40.77 0.03 OUTLIER 'General case' 0 C--N 1.35 0.623 1 C-N-CA 135.318 5.447 . . . . 0.0 121.082 -173.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.531 ' CE2' HD12 ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.444 HG12 HD22 ' A' ' 63' ' ' LEU . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.449 HG22 ' CD1' ' A' ' 91' ' ' PHE 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 64' ' ' VAL . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.478 ' HB3' HG23 ' A' ' 88' ' ' VAL . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.524 ' HE ' ' HG2' ' A' ' 134' ' ' LYS 0.332 9.3 ptm180 -85.23 -66.66 0.87 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.524 ' HG2' ' HE ' ' A' ' 133' ' ' ARG . 4.7 mmmp? -81.03 39.57 0.5 Allowed 'General case' 0 C--N 1.37 1.464 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 15.0 tpt -92.09 -49.66 6.09 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 128.179 2.592 . . . . 0.0 109.18 174.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . 0.259 . . 93.74 36.84 0.01 OUTLIER 'General case' 0 C--N 1.363 1.189 0 C-N-CA 129.324 3.05 . . . . 0.0 112.911 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 . . . . . 0 C--N 1.362 1.114 0 C-N-CA 125.235 1.414 . . . . 0.0 109.162 176.945 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -59.16 -35.39 73.44 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 127.947 2.499 . . . . 0.0 116.598 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -72.49 -44.07 62.31 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 126.556 1.942 . . . . 0.0 113.434 174.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -68.82 -28.94 67.19 Favored 'General case' 0 C--N 1.375 1.687 0 C-N-CA 126.992 2.117 . . . . 0.0 113.994 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE2' HD23 ' A' ' 129' ' ' LEU . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.644 ' HB1' ' HB2' ' A' ' 56' ' ' LEU 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.462 ' HA ' ' O ' ' A' ' 107' ' ' GLY 0.465 8.5 t30 175.67 85.31 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.14 79.7 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 169.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.36 -9.34 3.5 Favored Glycine 0 C--N 1.36 1.915 0 CA-C-N 116.431 -0.35 . . . . 0.0 112.981 168.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.464 ' CD1' ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -105.0 -81.77 0.53 Allowed 'General case' 0 C--N 1.351 0.646 0 O-C-N 120.895 -1.356 . . . . 0.0 111.387 -175.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.464 ' H ' ' CD1' ' A' ' 105' ' ' LEU . 6.8 t -129.74 24.84 5.37 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.654 1.982 . . . . 0.0 110.308 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' ' 102' ' ' ASN . . . -88.1 68.93 2.91 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 120.718 -1.239 . . . . 0.0 113.42 -167.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.2 ptt-85 -161.96 32.35 0.12 Allowed 'General case' 0 C--N 1.35 0.592 0 CA-C-N 120.062 1.931 . . . . 0.0 106.622 -178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 64.8 m 73.94 79.19 0.12 Allowed 'General case' 0 C--N 1.365 1.27 0 C-N-CA 127.499 2.32 . . . . 0.0 113.875 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.27 112.69 24.46 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -76.6 -21.14 55.96 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 118.473 2.768 . . . . 0.0 118.473 -169.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.5 t -128.37 49.26 2.2 Favored 'General case' 0 C--N 1.348 0.543 0 C-N-CA 124.955 1.302 . . . . 0.0 108.795 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 p -118.16 4.67 7.05 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 O-C-N 121.34 -0.85 . . . . 0.0 112.222 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.5 m 74.58 48.83 0.11 Allowed 'General case' 0 C--N 1.369 1.415 0 C-N-CA 127.723 2.409 . . . . 0.0 108.216 -170.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -62.49 63.98 0.01 OUTLIER 'General case' 0 C--N 1.364 1.208 0 C-N-CA 130.898 3.679 . . . . 0.0 117.1 -168.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -120.36 125.93 49.24 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.454 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.558 ' HG2' HD11 ' A' ' 125' ' ' ILE . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.558 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.506 HD23 ' CE2' ' A' ' 91' ' ' PHE . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 85' ' ' PRO . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 24.02 66.13 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 30.7 mmmt 82.19 47.02 0.02 OUTLIER 'General case' 0 C--N 1.367 1.343 0 C-N-CA 128.487 2.715 . . . . 0.0 111.897 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.2 ttt -62.37 -27.09 68.83 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.937 3.295 . . . . 0.0 116.688 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -164.33 167.8 19.38 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 104.669 -2.345 . . . . 0.0 104.669 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 . . . . . 0 C--N 1.357 0.907 0 N-CA-C 106.603 -1.629 . . . . 0.0 106.603 179.056 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -86.53 -2.59 58.6 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.77 2.428 . . . . 0.0 115.888 -176.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.2 t -67.34 -54.19 26.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.2 0 C-N-CA 127.255 2.222 . . . . 0.0 114.352 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -68.73 -27.33 65.84 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.581 3.152 . . . . 0.0 112.421 173.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 52' ' ' HIS . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 58.1 t30 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.413 ' HB2' HG22 ' A' ' 47' ' ' ILE . 57.5 m170 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 56' ' ' LEU 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.466 ' HA ' HG22 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE2' HD23 ' A' ' 129' ' ' LEU . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.492 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.607 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 91' ' ' PHE . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.406 ' HB3' ' HG ' ' A' ' 56' ' ' LEU . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER -77.42 -10.21 59.33 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.04 16.69 17.24 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 120.539 -1.351 . . . . 0.0 114.42 174.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.03 -11.9 66.75 Favored Glycine 0 C--N 1.362 1.974 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 154.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.4 4.0 pp -118.4 -51.89 2.39 Favored 'General case' 0 C--N 1.368 1.386 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 177.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.2 m -89.53 28.14 1.35 Allowed 'General case' 0 C--N 1.369 1.428 0 C-N-CA 129.632 3.173 . . . . 0.0 106.863 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.96 -32.41 53.16 Favored Glycine 0 C--N 1.353 1.519 0 C-N-CA 129.186 3.279 . . . . 0.0 116.285 -164.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -104.36 -9.27 18.62 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 126.938 2.095 . . . . 0.0 111.808 177.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.8 p -125.82 25.89 6.76 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.095 1.758 . . . . 0.0 111.967 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 88.3 mtp -18.29 33.86 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 2 C-N-CA 135.956 5.703 . . . . 0.0 124.32 -176.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.8 t70 80.95 -64.91 0.16 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 130.889 3.675 . . . . 0.0 110.204 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 17.3 p -133.99 -66.78 0.61 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 100.908 -3.738 . . . . 0.0 100.908 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.36 2.5 p 115.29 128.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.948 1 C-N-CA 132.644 4.378 . . . . 0.0 105.781 174.545 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 5.3 t 79.03 44.15 0.06 Allowed 'General case' 0 C--N 1.37 1.478 0 C-N-CA 125.218 1.407 . . . . 0.0 109.599 -174.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -85.04 168.2 15.13 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 129.681 3.192 . . . . 0.0 115.362 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -116.62 140.43 49.4 Favored 'General case' 0 C--N 1.359 0.997 0 O-C-N 120.562 -1.336 . . . . 0.0 107.788 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.537 HD11 ' HB1' ' A' ' 67' ' ' ALA . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -61.65 -31.29 71.39 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -18.17 50.88 Favored 'General case' 0 C--N 1.384 2.082 0 CA-C-N 122.07 2.213 . . . . 0.0 115.234 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 20.4 mmt -90.71 -6.95 53.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 129.496 3.118 . . . . 0.0 114.083 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.01 54.39 1.89 Allowed 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.249 1.82 . . . . 0.0 113.944 178.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--N 1.353 0.719 0 C-N-CA 125.986 1.715 . . . . 0.0 109.128 -177.013 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 68.62 -51.33 0.57 Allowed 'General case' 0 C--N 1.363 1.186 0 C-N-CA 128.246 2.619 . . . . 0.0 115.717 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.7 m -60.78 -34.34 58.73 Favored 'Isoleucine or valine' 0 C--N 1.369 1.453 0 C-N-CA 129.921 3.288 . . . . 0.0 113.904 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER -62.87 -27.34 69.28 Favored 'General case' 0 C--N 1.366 1.317 0 C-N-CA 129.139 2.976 . . . . 0.0 114.777 173.022 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 52' ' ' HIS . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.566 ' HB3' HG22 ' A' ' 47' ' ' ILE . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 HG23 ' A' ' 64' ' ' VAL 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.542 HG23 HG12 ' A' ' 60' ' ' VAL . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.432 HG13 ' CG ' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.407 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HG3' HD11 ' A' ' 47' ' ' ILE . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 47' ' ' ILE 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' A' ' 103' ' ' ALA . 13.2 t-20 14.16 -78.23 0.0 OUTLIER 'General case' 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' H ' ' HB3' ' A' ' 102' ' ' ASN . . . -105.58 -38.93 6.27 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 110.481 -3.054 . . . . 0.0 114.977 -175.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.48 46.94 Favored Glycine 0 C--N 1.365 2.177 0 C-N-CA 126.023 1.773 . . . . 0.0 115.712 174.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -116.89 -53.95 2.45 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 125.423 1.489 . . . . 0.0 112.443 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.9 t -108.25 35.63 3.09 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 129.142 2.977 . . . . 0.0 108.459 -177.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.18 3.29 59.98 Favored Glycine 0 N--CA 1.435 -1.433 0 C-N-CA 128.451 2.929 . . . . 0.0 114.136 -177.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -101.79 -154.38 0.48 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.4 p -93.42 118.79 31.75 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 120.387 -1.445 . . . . 0.0 107.743 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 86.8 mtp -71.84 -10.77 60.26 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.247 2.219 . . . . 0.0 115.3 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.266 37.5 m-20 82.85 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 130.599 3.56 . . . . 0.0 112.515 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 38.3 p -81.98 68.1 8.24 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.511 1.924 . . . . 0.0 112.8 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.32 5.61 10.43 Favored 'Isoleucine or valine' 0 C--N 1.348 0.532 0 C-N-CA 126.459 1.904 . . . . 0.0 109.757 -177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.1 m 64.69 36.29 8.33 Favored 'General case' 0 C--N 1.374 1.662 0 C-N-CA 129.5 3.12 . . . . 0.0 111.214 -175.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.519 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE 0.502 0.2 OUTLIER 5.79 76.35 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 1 C-N-CA 133.767 4.827 . . . . 0.0 121.154 -169.44 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -40.55 26.17 0.0 OUTLIER 'General case' 0 C--N 1.351 0.654 2 C-N-CA 136.56 5.944 . . . . 0.0 123.374 -178.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CZ ' ' CD1' ' A' ' 115' ' ' TYR 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.6 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.6 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.507 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 -117.86 -39.76 3.07 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -94.64 -20.71 19.34 Favored 'General case' 0 C--N 1.365 1.273 0 CA-C-N 121.315 1.87 . . . . 0.0 114.823 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 42.0 mtt 66.82 -60.06 0.36 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 127.181 2.192 . . . . 0.0 116.555 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 76.51 -52.57 0.59 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 130.214 3.406 . . . . 0.0 113.411 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.36 1.065 0 C-N-CA 126.325 1.85 . . . . 0.0 111.119 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 121.405 0.622 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.14 -27.68 68.9 Favored 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.57 2.748 . . . . 0.0 114.799 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 m -64.46 -33.78 65.17 Favored 'Isoleucine or valine' 0 C--N 1.365 1.243 0 C-N-CA 129.638 3.175 . . . . 0.0 112.724 173.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm -67.13 -27.0 66.95 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 128.413 2.685 . . . . 0.0 113.989 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.573 ' O ' HG12 ' A' ' 60' ' ' VAL . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.678 HG13 ' HD3' ' A' ' 61' ' ' PRO 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.678 ' HD3' HG13 ' A' ' 60' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.426 HD23 HG23 ' A' ' 60' ' ' VAL . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 129' ' ' LEU . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 73' ' ' ASN . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB3' ' HG3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.568 ' ND2' ' H ' ' A' ' 134' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.429 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.506 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -98.96 -0.7 41.61 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.583 ' HB1' ' HA3' ' A' ' 107' ' ' GLY . . . -104.76 23.49 13.35 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 120.923 3.675 . . . . 0.0 120.923 -167.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -81.05 -8.48 87.35 Favored Glycine 0 C--N 1.352 1.444 0 O-C-N 118.497 -2.627 . . . . 0.0 112.204 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 105' ' ' LEU . 2.3 pt? -118.82 -60.9 1.71 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 128.664 2.786 . . . . 0.0 116.446 -178.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.1 t -87.58 -10.21 52.17 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 125.187 1.395 . . . . 0.0 111.18 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.583 ' HA3' ' HB1' ' A' ' 103' ' ' ALA . . . -78.4 17.8 6.12 Favored Glycine 0 C--N 1.354 1.582 0 C-N-CA 128.874 3.131 . . . . 0.0 117.343 -169.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -157.82 8.53 0.16 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.642 2.777 . . . . 0.0 110.352 -170.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.5 m -97.22 71.74 2.41 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 174.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.0 mtt -50.62 -49.14 57.5 Favored 'General case' 0 C--N 1.366 1.286 0 C-N-CA 129.723 3.209 . . . . 0.0 118.912 -168.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.7 t70 66.63 -78.88 0.04 OUTLIER 'General case' 0 C--N 1.37 1.491 0 C-N-CA 126.942 2.097 . . . . 0.0 114.274 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 43.2 p -98.93 -41.86 7.4 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.65 1.98 . . . . 0.0 110.436 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.479 0.3 OUTLIER 103.99 -18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.043 0 C-N-CA 130.72 3.608 . . . . 0.0 111.419 -176.23 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.5 t -95.99 9.48 40.59 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.817 1.647 . . . . 0.0 110.624 171.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.41 ' HB3' ' ND2' ' A' ' 116' ' ' ASN . 5.4 m-30 43.7 -93.97 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 130.379 3.472 . . . . 0.0 118.616 177.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.41 ' ND2' ' HB3' ' A' ' 115' ' ' TYR . 8.0 p30 -157.65 4.06 0.12 Allowed 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.721 2.009 . . . . 0.0 114.178 -165.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 129' ' ' LEU 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 67' ' ' ALA . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -98.18 -41.11 8.05 Favored 'General case' 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.568 ' H ' ' ND2' ' A' ' 73' ' ' ASN 0.436 0.0 OUTLIER -40.86 -41.37 1.58 Allowed 'General case' 0 C--N 1.376 1.735 0 N-CA-C 120.047 3.351 . . . . 0.0 120.047 -174.406 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -15.94 61.3 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 175.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -100.85 5.62 43.47 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 126.694 1.998 . . . . 0.0 114.662 -174.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 . . . . . 0 C--N 1.364 1.214 0 C-N-CA 128.636 2.774 . . . . 0.0 115.31 176.56 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.5 ptt85 -90.01 -12.47 38.5 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.921 2.088 . . . . 0.0 113.927 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.7 t -70.5 -45.26 75.44 Favored 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 127.096 2.158 . . . . 0.0 114.295 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? -68.12 -26.39 65.77 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.664 1.986 . . . . 0.0 113.437 173.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 93' ' ' ALA 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.525 HG22 HG23 ' A' ' 92' ' ' VAL 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HA ' ' HD2' ' A' ' 61' ' ' PRO 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 5 4 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' ' HA ' ' A' ' 58' ' ' GLU . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.489 ' HD1' ' H ' ' A' ' 83' ' ' SER 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.489 ' H ' ' HD1' ' A' ' 75' ' ' PHE . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.558 ' O ' HG13 ' A' ' 92' ' ' VAL 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.683 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.487 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.427 ' CD2' HG22 ' A' ' 121' ' ' ILE . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -73.19 14.16 0.34 Allowed 'General case' 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -36.99 -34.61 0.08 Allowed 'General case' 0 C--N 1.366 1.292 1 C-N-CA 132.953 4.501 . . . . 0.0 120.633 -171.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.68 42.16 0.09 OUTLIER Glycine 0 CA--C 1.481 -2.089 0 N-CA-C 107.847 -2.101 . . . . 0.0 107.847 165.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -118.07 -77.44 0.57 Allowed 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 122.886 1.327 . . . . 0.0 108.654 -177.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.485 ' H ' HD12 ' A' ' 105' ' ' LEU . 97.9 m -79.37 -35.26 41.11 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 129.153 2.981 . . . . 0.0 111.452 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.74 82.59 0.5 Allowed Glycine 0 C--N 1.361 1.955 0 C-N-CA 128.905 3.145 . . . . 0.0 115.898 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -55.09 83.82 0.0 OUTLIER 'General case' 0 C--N 1.372 1.556 0 C-N-CA 128.322 2.649 . . . . 0.0 115.642 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.6 t 74.6 28.09 1.27 Allowed 'General case' 0 C--N 1.368 1.399 0 C-N-CA 129.679 3.191 . . . . 0.0 111.22 -173.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.345 10.8 ttt 51.56 35.38 14.48 Favored 'General case' 0 C--N 1.371 1.519 1 C-N-CA 132.194 4.198 . . . . 0.0 116.647 -176.602 . . . . . . . . 3 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 69.16 16.79 8.52 Favored 'General case' 0 C--N 1.365 1.255 0 C-N-CA 129.194 2.997 . . . . 0.0 113.801 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.352 0.7 OUTLIER 112.41 -31.07 0.01 OUTLIER 'General case' 0 C--N 1.361 1.066 0 C-N-CA 131.683 3.993 . . . . 0.0 110.153 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.43 0.4 OUTLIER 88.48 146.73 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.36 0 C-N-CA 126.662 1.985 . . . . 0.0 111.847 -178.279 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 16.0 t 72.16 28.08 2.51 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 125.494 1.517 . . . . 0.0 110.054 -168.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -52.2 172.2 0.04 OUTLIER 'General case' 0 C--N 1.366 1.323 1 C-N-CA 134.776 5.23 . . . . 0.0 120.666 -174.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.12 130.98 14.19 Favored 'General case' 0 C--N 1.365 1.246 0 O-C-N 119.72 -1.862 . . . . 0.0 114.708 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.56 ' HB3' HD22 ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.479 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.479 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.67 -24.01 18.03 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -29.39 67.9 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -171.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 19.6 ptp -107.94 23.4 14.54 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 125.56 1.544 . . . . 0.0 112.214 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -72.79 60.86 0.52 Allowed 'General case' 0 C--N 1.361 1.085 0 C-N-CA 127.248 2.219 . . . . 0.0 115.67 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 . . . . . 0 C--N 1.359 1.015 0 C-N-CA 129.572 3.149 . . . . 0.0 113.316 179.417 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 . . . . . 0 N--CA 1.443 -0.825 0 CA-C-O 121.339 0.59 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -104.93 123.08 47.13 Favored 'General case' 0 C--N 1.348 0.53 0 C-N-CA 126.43 1.892 . . . . 0.0 107.6 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.85 -35.85 72.92 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 127.55 2.34 . . . . 0.0 116.081 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -68.4 -26.76 65.71 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 128.629 2.772 . . . . 0.0 112.816 172.591 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 6.1 m120 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.63 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.63 HG23 HD23 ' A' ' 56' ' ' LEU 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.574 HG13 HD23 ' A' ' 63' ' ' LEU 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 5 4 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.688 HD22 HD12 ' A' ' 121' ' ' ILE . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' LYS 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.448 ' HA ' ' CE2' ' A' ' 75' ' ' PHE 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' ASP 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 129' ' ' LEU . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.553 HG23 HG22 ' A' ' 57' ' ' THR 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.514 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER 96.13 65.66 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.18 22.43 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.61 27.13 55.2 Favored Glycine 0 C--N 1.366 2.203 0 C-N-CA 127.797 2.618 . . . . 0.0 116.634 174.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.4 pp -117.3 -36.92 3.63 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 126.664 1.986 . . . . 0.0 114.077 -175.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.4 t -117.69 25.07 10.66 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.713 2.405 . . . . 0.0 106.956 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -87.2 9.29 73.4 Favored Glycine 0 C--N 1.363 2.067 0 C-N-CA 127.403 2.43 . . . . 0.0 118.441 -165.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -104.91 30.22 5.69 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 125.739 1.616 . . . . 0.0 111.373 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.325 86.8 p 73.65 16.22 3.92 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 127.303 2.241 . . . . 0.0 116.219 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.4 mtp -63.11 51.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 131.383 3.873 . . . . 0.0 117.819 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -79.17 61.18 3.23 Favored 'General case' 0 C--N 1.357 0.914 0 O-C-N 119.317 -2.114 . . . . 0.0 113.168 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.391 22.1 p 125.4 122.01 0.0 OUTLIER 'General case' 0 C--N 1.356 0.848 1 C-N-CA 132.97 4.508 . . . . 0.0 107.803 -178.365 . . . . . . . . 3 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 114' ' ' SER . 9.8 p -164.68 -178.18 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 100.334 -3.95 . . . . 0.0 100.334 -177.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.432 ' H ' HG22 ' A' ' 113' ' ' VAL . 6.7 m -72.33 53.85 0.3 Allowed 'General case' 0 C--N 1.364 1.205 0 C-N-CA 127.892 2.477 . . . . 0.0 112.25 174.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -33.48 123.95 0.42 Allowed 'General case' 0 C--N 1.36 1.026 2 C-N-CA 135.794 5.638 . . . . 0.0 121.894 -170.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.98 23.26 0.01 OUTLIER 'General case' 0 C--N 1.356 0.858 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 120' ' ' GLU . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.688 HD12 HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.413 ' CD2' ' HG3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -94.04 -51.42 4.86 Favored 'General case' 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 39.39 0.73 Allowed 'General case' 0 C--N 1.37 1.487 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -174.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.3 mmt -132.02 -0.47 3.77 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 129.319 3.047 . . . . 0.0 107.427 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.93 151.97 44.65 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 125.059 1.344 . . . . 0.0 109.115 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 C--N 1.368 1.377 0 C-N-CA 125.463 1.505 . . . . 0.0 111.636 -179.717 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.6 mmt-85 -98.67 89.79 4.49 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.389 1.876 . . . . 0.0 106.77 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.409 HG23 ' H ' ' A' ' 41' ' ' VAL . 4.8 t -53.94 -35.81 29.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.284 0 C-N-CA 129.243 3.017 . . . . 0.0 115.628 -174.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -68.42 -27.61 66.35 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.237 2.215 . . . . 0.0 113.827 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.694 HG22 HG12 ' A' ' 92' ' ' VAL 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.516 ' CG1' HG22 ' A' ' 92' ' ' VAL 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 4 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 57' ' ' THR . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.442 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.422 ' O ' HD21 ' A' ' 105' ' ' LEU . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -161.34 55.44 0.28 Allowed 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.78 -78.94 0.52 Allowed 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.371 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -161.64 35.91 0.38 Allowed Glycine 0 C--N 1.352 1.468 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.545 HD23 ' H ' ' A' ' 106' ' ' THR . 0.9 OUTLIER -116.4 -66.4 1.09 Allowed 'General case' 0 C--N 1.348 0.514 0 C-N-CA 125.505 1.522 . . . . 0.0 107.461 177.797 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.545 ' H ' HD23 ' A' ' 105' ' ' LEU . 11.7 t -108.5 18.41 20.97 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 127.844 2.458 . . . . 0.0 108.722 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.66 -5.49 81.59 Favored Glycine 0 C--N 1.366 2.247 0 C-N-CA 127.223 2.344 . . . . 0.0 115.601 -179.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 171.6 -93.22 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 101.591 -3.485 . . . . 0.0 101.591 -176.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 t -176.8 53.01 0.01 OUTLIER 'General case' 0 C--N 1.348 0.524 0 N-CA-C 102.857 -3.016 . . . . 0.0 102.857 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.314 55.1 mtp 82.78 87.35 0.03 OUTLIER 'General case' 0 C--N 1.358 0.969 0 C-N-CA 127.99 2.516 . . . . 0.0 113.499 -176.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -73.68 -41.53 62.53 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.226 2.61 . . . . 0.0 111.113 176.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.8 t -161.9 168.89 22.19 Favored 'General case' 0 N--CA 1.437 -1.096 1 N-CA-C 99.607 -4.22 . . . . 0.0 99.607 178.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.1 p -155.25 -43.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.895 0 CA-C-N 119.664 1.12 . . . . 0.0 110.647 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 p -90.24 60.46 4.77 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 126.836 2.055 . . . . 0.0 107.315 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.27 159.68 15.5 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 128.851 2.861 . . . . 0.0 116.582 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -126.7 136.19 52.13 Favored 'General case' 0 C--N 1.356 0.85 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 175.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HD1' HD11 ' A' ' 121' ' ' ILE . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.409 HD11 ' HD1' ' A' ' 117' ' ' PHE 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.457 HG22 ' HD1' ' A' ' 91' ' ' PHE 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.465 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 116.12 15.52 Favored 'General case' 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.42 14.3 mmmm 102.25 -9.3 0.03 OUTLIER 'General case' 0 C--N 1.377 1.774 0 C-N-CA 128.896 2.878 . . . . 0.0 113.604 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.3 mmm -110.74 27.66 9.44 Favored 'General case' 0 C--N 1.361 1.103 0 O-C-N 120.209 -1.557 . . . . 0.0 111.647 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -84.87 42.69 0.94 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.977 2.511 . . . . 0.0 113.516 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 . . . . . 0 C--N 1.354 0.789 0 C-N-CA 125.807 1.643 . . . . 0.0 107.866 179.918 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -133.41 45.32 2.7 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 125.688 1.595 . . . . 0.0 108.941 -177.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.7 p -54.8 -41.45 57.0 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 130.807 3.643 . . . . 0.0 116.418 -176.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER -67.01 -27.32 67.32 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 127.579 2.352 . . . . 0.0 114.729 174.509 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 52' ' ' HIS . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.45 ' HB2' HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.431 HG22 HG23 ' A' ' 92' ' ' VAL 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.605 ' CG1' HG12 ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 121' ' ' ILE . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.452 ' HG2' HG23 ' A' ' 88' ' ' VAL . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.603 HG11 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.605 HG12 ' CG1' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.563 ' CE1' HG23 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.21 -9.8 55.86 Favored 'General case' 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.6 35.62 0.83 Allowed 'General case' 0 C--N 1.361 1.108 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.1 -24.05 42.46 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 162.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.301 2.3 pt? -118.53 -57.82 2.03 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 117.629 2.455 . . . . 0.0 117.629 -177.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.3 t -97.61 37.2 1.4 Allowed 'General case' 0 C--N 1.363 1.177 0 C-N-CA 127.979 2.512 . . . . 0.0 106.782 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.81 178.41 53.68 Favored Glycine 0 C--N 1.351 1.397 1 C-N-CA 132.059 4.647 . . . . 0.0 113.694 -178.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.7 ttp85 144.03 -29.94 0.01 OUTLIER 'General case' 0 C--N 1.368 1.402 0 N-CA-C 101.092 -3.67 . . . . 0.0 101.092 -173.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 m -45.93 76.49 0.0 OUTLIER 'General case' 0 C--N 1.371 1.529 1 C-N-CA 134.488 5.115 . . . . 0.0 116.688 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 40.6 ttp -106.28 177.7 4.78 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.853 1.661 . . . . 0.0 107.462 178.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -76.26 68.4 2.65 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 119.278 -2.139 . . . . 0.0 112.757 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.319 76.8 p 94.0 130.79 0.02 OUTLIER 'General case' 0 C--N 1.363 1.176 0 C-N-CA 131.448 3.899 . . . . 0.0 108.155 -171.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.7 p -158.79 37.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.126 0 CA-C-O 124.797 2.237 . . . . 0.0 106.477 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.261 8.5 t 98.03 -31.06 0.02 OUTLIER 'General case' 0 C--N 1.357 0.933 0 C-N-CA 130.855 3.662 . . . . 0.0 108.859 -171.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 165.77 13.87 Favored 'General case' 0 C--N 1.366 1.31 0 C-N-CA 126.593 1.957 . . . . 0.0 115.81 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -131.72 164.75 25.27 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.797 HG22 ' HD2' ' A' ' 122' ' ' PRO 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.797 ' HD2' HG22 ' A' ' 121' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.603 ' CG ' HG11 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -7.52 -47.85 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 4 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? -65.33 -4.9 6.07 Favored 'General case' 0 C--N 1.374 1.639 0 C-N-CA 127.994 2.517 . . . . 0.0 114.857 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 -24.69 41.83 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 129.172 2.989 . . . . 0.0 111.718 170.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 66.96 -47.28 0.47 Allowed 'General case' 0 C--N 1.369 1.421 0 C-N-CA 129.567 3.147 . . . . 0.0 117.512 177.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 . . . . . 0 C--N 1.358 0.966 0 C-N-CA 129.943 3.297 . . . . 0.0 113.467 -179.334 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -119.5 146.51 45.38 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 105.739 176.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.65 -40.65 51.83 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 128.996 2.919 . . . . 0.0 114.415 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -28.39 67.18 Favored 'General case' 0 C--N 1.365 1.243 0 C-N-CA 128.403 2.681 . . . . 0.0 113.572 175.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.4 ' O ' ' HD3' ' A' ' 61' ' ' PRO 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.508 ' HE3' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG1' HG12 ' A' ' 60' ' ' VAL 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.556 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 68' ' ' LYS 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.538 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.486 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.508 ' CE2' ' HE3' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -104.68 -54.42 2.51 Favored 'General case' 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.96 8.4 23.38 Favored 'General case' 0 C--N 1.377 1.783 0 O-C-N 119.849 -1.782 . . . . 0.0 115.703 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -82.98 -22.09 58.16 Favored Glycine 0 C--N 1.347 1.155 0 C-N-CA 126.693 2.092 . . . . 0.0 110.083 161.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.477 1.6 pt? -120.64 -53.08 2.11 Favored 'General case' 0 C--N 1.369 1.455 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 175.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -118.1 37.9 3.85 Favored 'General case' 0 CA--C 1.487 -1.448 0 C-N-CA 127.599 2.36 . . . . 0.0 106.807 -168.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.19 23.3 6.23 Favored Glycine 0 N--CA 1.432 -1.578 0 C-N-CA 127.329 2.395 . . . . 0.0 118.894 -167.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.5 mtm-85 65.64 -58.72 0.3 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 128.623 2.769 . . . . 0.0 117.9 170.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.0 t -88.58 -51.66 5.57 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 127.732 2.413 . . . . 0.0 108.543 173.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' MET . . . . . 0.405 ' HG2' ' H ' ' A' ' 111' ' ' ASP . 4.7 ttt -164.82 -179.27 5.72 Favored 'General case' 0 C--N 1.362 1.126 0 CA-C-O 121.635 0.731 . . . . 0.0 109.062 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' HG2' ' A' ' 110' ' ' MET . 0.3 OUTLIER -97.21 89.28 4.71 Favored 'General case' 0 C--N 1.352 0.699 0 C-N-CA 130.599 3.559 . . . . 0.0 112.13 -179.167 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.38 2.4 t 65.54 32.19 9.54 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 129.414 3.086 . . . . 0.0 117.209 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.3 t -127.75 -75.33 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.366 0 O-C-N 119.393 -2.067 . . . . 0.0 107.729 -176.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 12.6 p -88.27 35.41 0.76 Allowed 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.633 2.373 . . . . 0.0 110.739 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.02 61.72 4.71 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.806 2.042 . . . . 0.0 112.457 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -67.94 100.23 0.94 Allowed 'General case' 0 C--N 1.364 1.232 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -174.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.679 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.679 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.556 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -105.24 -87.4 0.45 Allowed 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -82.61 76.73 9.45 Favored 'General case' 0 C--N 1.353 0.738 0 O-C-N 120.205 -1.56 . . . . 0.0 112.297 -178.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.77 -46.87 28.4 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 127.692 2.397 . . . . 0.0 112.55 177.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -173.2 -174.19 1.01 Allowed 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . 0.256 10.2 mpt_? . . . . . 0 C--N 1.364 1.233 0 C-N-CA 128.356 2.662 . . . . 0.0 113.265 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.742 HD13 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.742 ' H ' HD13 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 73' ' ' ASN 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' ALA 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.472 HD21 ' HG2' ' A' ' 68' ' ' LYS 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 73' ' ' ASN . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.695 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.695 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.454 ' HB1' HG22 ' A' ' 121' ' ' ILE . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.418 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.454 HG22 ' HB1' ' A' ' 95' ' ' ALA 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.418 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.458 ' H ' HD13 ' A' ' 125' ' ' ILE 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.368 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HG ' ' A' ' 56' ' ' LEU . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.549 HG13 HD23 ' A' ' 63' ' ' LEU 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.599 HD22 ' HB ' ' A' ' 121' ' ' ILE . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.597 HG21 HG13 ' A' ' 88' ' ' VAL . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.449 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 85' ' ' PRO . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 84' ' ' ILE . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 64' ' ' VAL . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.458 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.458 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.487 ' HB3' HG21 ' A' ' 60' ' ' VAL . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.449 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.434 -1.259 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.599 ' HB ' HD22 ' A' ' 63' ' ' LEU 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' ' 125' ' ' ILE . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 125' ' ' ILE 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 64' ' ' VAL . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 C--O 1.222 -0.376 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.429 ' HB3' HD22 ' A' ' 49' ' ' ASN . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.429 HD22 ' HB3' ' A' ' 45' ' ' LEU . 42.0 m-20 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.52 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 92' ' ' VAL 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.501 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.463 HG23 HG12 ' A' ' 60' ' ' VAL . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.432 ' O ' HG13 ' A' ' 92' ' ' VAL 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.591 HG23 HG22 ' A' ' 57' ' ' THR 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.499 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HB3' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 115.138 1.532 . . . . 0.0 115.138 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.4 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.558 ' H ' HD13 ' A' ' 125' ' ' ILE 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 . . . . . 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.49 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.49 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.67 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.448 ' H ' HD23 ' A' ' 56' ' ' LEU 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.705 HG13 HD23 ' A' ' 63' ' ' LEU 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.527 HG23 HG12 ' A' ' 60' ' ' VAL . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.455 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HB1' HD11 ' A' ' 129' ' ' LEU . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.501 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' VAL . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG23 ' A' ' 92' ' ' VAL 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 88' ' ' VAL . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.67 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER . . . . . 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.457 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.495 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 64' ' ' VAL . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.477 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--O 1.222 -0.373 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' CD2' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.442 ' CD2' ' CE1' ' A' ' 52' ' ' HIS . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 96' ' ' ALA 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.441 HG22 HG12 ' A' ' 92' ' ' VAL 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.442 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.407 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 117' ' ' PHE . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' A' ' 129' ' ' LEU . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.442 ' HA ' HG11 ' A' ' 60' ' ' VAL . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.533 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 121' ' ' ILE . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 56' ' ' LEU 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.441 ' CG ' HG22 ' A' ' 121' ' ' ILE . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 . . . . . 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 . . . . . 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.412 ' HB2' ' HB2' ' A' ' 63' ' ' LEU . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.651 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.651 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.401 HG23 HD13 ' A' ' 125' ' ' ILE . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 124' ' ' THR 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.489 HD23 ' CE2' ' A' ' 91' ' ' PHE . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 41.6 ttp180 . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.521 HG22 HG23 ' A' ' 92' ' ' VAL 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.446 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.564 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.42 HG23 ' H ' ' A' ' 88' ' ' VAL . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.521 HG23 HG22 ' A' ' 57' ' ' THR 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.472 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.423 HD22 ' HA ' ' A' ' 102' ' ' ASN 0.289 2.4 t-20 . . . . . 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.495 HD22 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.806 0 N-CA-C 116.785 2.143 . . . . 0.0 116.785 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.495 ' N ' HD22 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.576 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.443 ' CD ' HG22 ' A' ' 121' ' ' ILE . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.434 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.51 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 54' ' ' GLU . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.547 HD13 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.547 ' H ' HD13 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.467 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.566 HG12 ' CE2' ' A' ' 91' ' ' PHE 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.461 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 1.5 p30 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 132' ' ' TYR 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' HG22 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE2' HG12 ' A' ' 64' ' ' VAL . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.588 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.481 ' HA ' HG23 ' A' ' 121' ' ' ILE . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.616 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.616 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.56 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.461 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 . . . . . 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER . . . . . 0 C--O 1.214 -0.792 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.654 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.422 ' N ' HD23 ' A' ' 56' ' ' LEU 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.62 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 62' ' ' LEU 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 133' ' ' ARG 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.4 HD22 ' HB3' ' A' ' 68' ' ' LYS 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.434 ' HA ' ' HB3' ' A' ' 91' ' ' PHE 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 88' ' ' VAL . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.62 HG12 ' HB ' ' A' ' 60' ' ' VAL 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.654 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.584 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.465 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.612 ' HG2' HD11 ' A' ' 125' ' ' ILE . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.612 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.496 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.418 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 25.5 ttt180 . . . . . 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp . . . . . 0 C--O 1.22 -0.461 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.726 HG23 ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.726 ' H ' HG23 ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.419 ' HG3' HD11 ' A' ' 84' ' ' ILE . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.419 HD11 ' HG3' ' A' ' 61' ' ' PRO . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CD ' HG21 ' A' ' 48' ' ' THR . 7.5 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.475 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 . . . . . 0 CA--C 1.505 -0.781 0 CA-C-O 122.995 1.379 . . . . 0.0 108.189 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.453 ' CZ ' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.644 HD13 ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? . . . . . 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.459 HG23 ' HB2' ' A' ' 52' ' ' HIS . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.459 ' HB2' HG23 ' A' ' 47' ' ' ILE . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.447 HD23 HG13 ' A' ' 60' ' ' VAL . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.45 ' HG2' ' HB2' ' A' ' 132' ' ' TYR 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.422 HD21 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.466 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.442 ' O ' HD13 ' A' ' 90' ' ' ILE . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.465 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.442 HD13 ' O ' ' A' ' 87' ' ' GLY 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.487 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.731 0 N-CA-C 116.404 2.001 . . . . 0.0 116.404 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.45 ' HB2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.415 ' HB2' ' HG3' ' A' ' 85' ' ' PRO . 6.2 tmm_? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.588 HG22 HG23 ' A' ' 92' ' ' VAL 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 61' ' ' PRO . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.641 HG21 ' HA ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 58' ' ' GLU 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' CE2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 121' ' ' ILE . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 129' ' ' LEU 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 92' ' ' VAL 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 125' ' ' ILE . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 88' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 . . . . . 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.228 0 N-CA-C 121.082 3.734 . . . . 0.0 121.082 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.531 ' CE2' HD12 ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.444 HG12 HD22 ' A' ' 63' ' ' LEU . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.449 HG22 ' CD1' ' A' ' 91' ' ' PHE 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 64' ' ' VAL . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.478 ' HB3' HG23 ' A' ' 88' ' ' VAL . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.428 ' H ' ' HB2' ' A' ' 132' ' ' TYR 0.332 9.3 ptm180 . . . . . 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE2' HD23 ' A' ' 129' ' ' LEU . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.644 ' HB1' ' HB2' ' A' ' 56' ' ' LEU 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.465 2.3 t-20 . . . . . 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.462 HD22 ' HA ' ' A' ' 116' ' ' ASN . 4.8 m120 . . . . . 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.454 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.558 ' HG2' HD11 ' A' ' 125' ' ' ILE . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.558 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.506 HD23 ' CE2' ' A' ' 91' ' ' PHE . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 85' ' ' PRO . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 . . . . . 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 52' ' ' HIS . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.413 ' HB2' HG22 ' A' ' 47' ' ' ILE . 12.5 m-70 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 56' ' ' LEU 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.466 ' HA ' HG22 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE2' HD23 ' A' ' 129' ' ' LEU . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.492 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.607 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 91' ' ' PHE . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.406 ' HB3' ' HG ' ' A' ' 56' ' ' LEU . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER . . . . . 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.513 -0.47 0 CA-C-O 122.675 1.226 . . . . 0.0 107.788 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.537 HD11 ' HB1' ' A' ' 67' ' ' ALA . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 52' ' ' HIS . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.566 ' HB3' HG22 ' A' ' 47' ' ' ILE . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 HG23 ' A' ' 64' ' ' VAL 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.542 HG23 HG12 ' A' ' 60' ' ' VAL . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.432 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.432 HG13 ' CG ' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.407 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HG3' HD11 ' A' ' 47' ' ' ILE . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 47' ' ' ILE 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 . . . . . 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.192 1 N-CA-C 123.374 4.583 . . . . 0.0 123.374 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.6 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.6 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . 0.507 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 . . . . . 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.573 ' O ' HG12 ' A' ' 60' ' ' VAL . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.678 HG13 ' HD3' ' A' ' 61' ' ' PRO 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.678 ' HD3' HG13 ' A' ' 60' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.426 HD23 HG23 ' A' ' 60' ' ' VAL . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 129' ' ' LEU . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 73' ' ' ASN . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.408 ' HB3' ' HG2' ' A' ' 68' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.429 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.506 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 129' ' ' LEU 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 67' ' ' ALA . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? . . . . . 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 93' ' ' ALA 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.525 HG22 HG23 ' A' ' 92' ' ' VAL 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HA ' ' HD2' ' A' ' 61' ' ' PRO 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' ' HA ' ' A' ' 58' ' ' GLU . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.489 ' HD1' ' H ' ' A' ' 83' ' ' SER 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.489 ' H ' ' HD1' ' A' ' 75' ' ' PHE . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.558 ' O ' HG13 ' A' ' 92' ' ' VAL 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.683 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.487 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.427 ' CD2' HG22 ' A' ' 121' ' ' ILE . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.511 -0.543 0 CA-C-O 123.812 1.768 . . . . 0.0 114.708 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.56 ' HB3' HD22 ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.479 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.479 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.378 0 N-CA-C 112.816 0.672 . . . . 0.0 112.816 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.63 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.63 HG23 HD23 ' A' ' 56' ' ' LEU 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.574 HG13 HD23 ' A' ' 63' ' ' LEU 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.688 HD22 HD12 ' A' ' 121' ' ' ILE . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' LYS 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.448 ' HA ' ' CE2' ' A' ' 75' ' ' PHE 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.451 HD21 ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' ASP 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 129' ' ' LEU . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.553 HG23 HG22 ' A' ' 57' ' ' THR 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.514 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 120' ' ' GLU . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.688 HD12 HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.413 ' CD2' ' HG3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 . . . . . 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm . . . . . 0 CA--C 1.511 -0.533 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.694 HG22 HG12 ' A' ' 92' ' ' VAL 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.516 ' CG1' HG22 ' A' ' 92' ' ' VAL 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 57' ' ' THR . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.442 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 . . . . . 0 CA--C 1.507 -0.695 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HD1' HD11 ' A' ' 121' ' ' ILE . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.409 HD11 ' HD1' ' A' ' 117' ' ' PHE 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.457 HG22 ' HD1' ' A' ' 91' ' ' PHE 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.465 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 52' ' ' HIS . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.45 ' HB2' HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.431 HG22 HG23 ' A' ' 92' ' ' VAL 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.605 ' CG1' HG12 ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 121' ' ' ILE . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.452 ' HG2' HG23 ' A' ' 88' ' ' VAL . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.603 HG11 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.605 HG12 ' CG1' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.563 ' CE1' HG23 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 . . . . . 0 CA--C 1.502 -0.868 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.797 HG22 ' HD2' ' A' ' 122' ' ' PRO 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.797 ' HD2' HG22 ' A' ' 121' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.603 ' CG ' HG11 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 3 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.4 ' O ' ' HD3' ' A' ' 61' ' ' PRO 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.508 ' HE3' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG1' HG12 ' A' ' 60' ' ' VAL 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.556 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 68' ' ' LYS 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.538 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.486 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.508 ' CE2' ' HE3' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.0 m120 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.679 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.679 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . 0.556 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? . . . . . 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 . . . . . 0 N--CA 1.44 -0.928 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.287 84.3 mtm180 87.57 -19.67 0.23 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 129.659 3.183 . . . . 0.0 113.033 -178.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 t -63.11 -38.97 83.48 Favored 'Isoleucine or valine' 0 C--N 1.368 1.38 0 C-N-CA 129.009 2.924 . . . . 0.0 112.894 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -63.44 -27.55 69.36 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 129.91 3.284 . . . . 0.0 113.917 174.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -62.31 -24.39 67.28 Favored 'General case' 0 C--N 1.357 0.912 0 C-N-CA 127.782 2.433 . . . . 0.0 115.114 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.8 mt -77.54 -40.96 40.81 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.699 2.399 . . . . 0.0 113.784 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.16 -18.79 17.49 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.261 1.824 . . . . 0.0 114.723 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.9 m -71.83 -10.41 59.73 Favored 'General case' 0 C--N 1.379 1.874 0 C-N-CA 126.343 1.857 . . . . 0.0 113.816 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 21.2 pt -105.91 -119.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 127.032 2.133 . . . . 0.0 112.238 -173.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.0 p -78.21 58.13 1.99 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.361 3.064 . . . . 0.0 112.548 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -156.55 -80.4 0.07 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 131.477 3.911 . . . . 0.0 102.914 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.3 -38.72 71.63 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -88.54 -47.35 8.38 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-O 122.684 1.23 . . . . 0.0 111.842 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -135.27 38.1 2.95 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -168.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -53.5 -36.6 61.9 Favored 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.657 2.935 . . . . 0.0 113.397 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.47 -35.24 68.17 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.851 1.661 . . . . 0.0 113.975 171.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.334 4.7 t80 -77.28 -49.15 15.66 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 118.859 -2.4 . . . . 0.0 116.512 177.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.742 HD13 ' H ' ' A' ' 57' ' ' THR . 0.0 OUTLIER -69.43 -51.33 37.39 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-N 121.522 1.964 . . . . 0.0 114.356 -178.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.742 ' H ' HD13 ' A' ' 56' ' ' LEU 0.488 0.1 OUTLIER -49.9 -32.51 14.8 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 173.601 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -71.95 -35.46 69.59 Favored 'General case' 0 C--N 1.372 1.547 0 CA-C-N 121.839 2.109 . . . . 0.0 116.128 173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.3 mtm -49.27 -45.33 44.75 Favored 'General case' 0 C--N 1.382 1.986 0 C-N-CA 129.88 3.272 . . . . 0.0 112.833 172.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.51 1.1 t -71.6 -49.78 10.95 Favored Pre-proline 0 C--O 1.21 -0.998 0 CA-C-O 111.956 -3.878 . . . . 0.0 115.856 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.53 -18.89 21.29 Favored 'Trans proline' 0 C--N 1.369 1.621 2 CA-C-N 134.522 6.222 . . . . 0.0 114.991 165.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.53 -41.27 98.47 Favored 'General case' 0 C--N 1.373 1.616 0 CA-C-N 121.397 1.908 . . . . 0.0 113.095 158.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 tp -70.93 -53.04 16.45 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 169.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.6 t -63.36 -44.33 98.96 Favored 'Isoleucine or valine' 0 C--N 1.363 1.18 1 C-N-CA 132.151 4.18 . . . . 0.0 114.185 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.462 30.8 mt-10 -78.66 -41.04 32.35 Favored 'General case' 0 C--N 1.366 1.287 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.338 0.0 OUTLIER -67.54 -49.05 65.15 Favored 'General case' 0 C--N 1.387 2.218 0 O-C-N 120.322 -1.486 . . . . 0.0 114.277 175.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.433 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -70.55 -35.53 73.15 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.371 1.868 . . . . 0.0 113.998 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.499 ' HZ1' ' HA ' ' A' ' 135' ' ' MET 0.828 2.8 tttp -75.83 -20.98 57.73 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.941 2.201 . . . . 0.0 116.941 171.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -52.91 -22.64 5.78 Favored 'General case' 0 C--N 1.383 2.055 0 C-N-CA 128.418 2.687 . . . . 0.0 114.503 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 67' ' ' ALA 0.273 3.4 tp10 -56.59 -46.05 81.05 Favored 'General case' 0 C--N 1.352 0.681 1 C-N-CA 137.072 6.149 . . . . 0.0 113.48 168.448 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 66.3 m -85.44 -25.74 26.76 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 127.429 2.292 . . . . 0.0 113.655 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.36 14.03 3.73 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.267 3.027 . . . . 0.0 114.63 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.472 HD21 ' HG2' ' A' ' 68' ' ' LYS 0.354 0.0 OUTLIER -77.9 161.06 72.63 Favored Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -176.059 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 73' ' ' ASN . 87.5 Cg_endo -81.83 64.25 8.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 123.996 3.13 . . . . 0.0 113.988 -163.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.22 14.94 3.15 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 126.387 1.875 . . . . 0.0 110.791 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -117.24 151.45 19.12 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 C-N-CA 130.704 3.602 . . . . 0.0 106.593 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.03 165.36 12.97 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.546 1.538 . . . . 0.0 109.237 -178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 tttp -50.8 -14.3 0.2 Allowed 'General case' 0 C--N 1.37 1.467 0 N-CA-C 120.145 3.387 . . . . 0.0 120.145 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -99.45 -11.52 21.03 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 119.735 -1.853 . . . . 0.0 109.6 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.97 26.53 26.24 Favored Glycine 0 C--N 1.361 1.933 0 C-N-CA 129.652 3.501 . . . . 0.0 112.731 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -96.49 179.34 5.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 127.475 2.31 . . . . 0.0 107.429 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.07 143.68 45.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.294 2.638 . . . . 0.0 116.352 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.4 t -141.63 141.48 33.42 Favored 'General case' 0 C--N 1.36 1.022 0 O-C-N 120.313 -1.492 . . . . 0.0 107.108 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.5 mp -141.32 134.69 14.53 Favored Pre-proline 0 C--N 1.363 1.169 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 -177.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -84.25 -176.6 2.65 Favored 'Trans proline' 0 C--N 1.365 1.403 1 C-N-CA 125.331 4.021 . . . . 0.0 112.43 177.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -59.34 -45.31 91.72 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.423 3.12 . . . . 0.0 119.423 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.0 -45.72 15.36 Favored Glycine 0 N--CA 1.503 3.105 0 O-C-N 119.636 -1.915 . . . . 0.0 112.906 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.24 -23.07 32.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.433 1.893 . . . . 0.0 113.353 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.695 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.3 tt -67.5 -46.73 72.05 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.307 3.043 . . . . 0.0 111.475 170.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.307 0.2 OUTLIER -60.23 -32.66 51.22 Favored 'Isoleucine or valine' 0 C--N 1.384 2.103 0 CA-C-N 119.033 0.833 . . . . 0.0 112.395 174.442 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -63.7 -58.07 8.04 Favored 'General case' 0 C--N 1.382 2.001 0 C-N-CA 127.123 2.169 . . . . 0.0 111.048 167.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.695 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.447 16.9 m -52.02 -52.94 20.39 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 CA-C-N 122.357 2.344 . . . . 0.0 115.112 -178.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.21 -51.18 68.81 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 117.03 2.234 . . . . 0.0 117.03 169.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.528 40.2 pttt -75.38 -30.27 60.12 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 122.45 2.386 . . . . 0.0 116.81 -176.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.454 ' HB1' HG22 ' A' ' 121' ' ' ILE . . . -64.58 -52.35 58.04 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 129.199 2.999 . . . . 0.0 113.214 174.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.284 . . -78.3 -28.6 47.49 Favored 'General case' 0 C--N 1.365 1.258 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 177.517 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 8.9 pt20 -73.52 -24.98 60.22 Favored 'General case' 0 C--N 1.375 1.681 0 CA-C-N 121.411 1.914 . . . . 0.0 112.326 173.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.418 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 0.3 OUTLIER -73.05 -54.7 7.89 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.652 1.581 . . . . 0.0 109.882 167.161 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.81 -47.3 66.42 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -177.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 tmm? -71.11 -43.59 67.35 Favored 'General case' 0 C--N 1.363 1.194 0 CA-C-N 120.668 1.576 . . . . 0.0 113.556 -174.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.409 ' O ' HD21 ' A' ' 105' ' ' LEU . 0.2 OUTLIER -67.77 -22.55 65.2 Favored 'General case' 0 C--N 1.366 1.321 0 C-N-CA 130.608 3.563 . . . . 0.0 113.38 175.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -95.1 -63.34 1.18 Allowed 'General case' 0 C--N 1.361 1.095 0 C-N-CA 125.12 1.368 . . . . 0.0 110.866 173.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.25 12.22 33.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.855 3.28 . . . . 0.0 119.855 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -80.23 -17.08 74.96 Favored Glycine 0 C--N 1.357 1.707 0 O-C-N 119.331 -2.106 . . . . 0.0 110.3 161.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.598 ' H ' HD23 ' A' ' 105' ' ' LEU . 0.6 OUTLIER -117.46 -56.2 2.24 Favored 'General case' 0 CA--C 1.493 -1.235 0 C-N-CA 129.096 2.958 . . . . 0.0 117.026 -176.147 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 47.5 p -91.78 12.39 21.55 Favored 'General case' 0 C--N 1.355 0.827 0 CA-C-O 123.598 1.666 . . . . 0.0 111.028 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -64.33 3.93 Favored Glycine 0 C--N 1.35 1.317 1 C-N-CA 135.135 6.112 . . . . 0.0 119.939 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.259 53.2 ttt180 87.15 -10.87 0.58 Allowed 'General case' 0 C--N 1.36 1.064 0 C-N-CA 129.188 2.995 . . . . 0.0 115.561 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 57.4 m -110.63 31.31 6.07 Favored 'General case' 0 C--N 1.362 1.116 0 O-C-N 119.908 -1.745 . . . . 0.0 113.999 -177.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.275 12.9 tpt 80.52 145.99 0.08 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.69 2.796 . . . . 0.0 117.476 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -87.83 20.09 3.21 Favored 'General case' 0 C--N 1.368 1.381 0 C-N-CA 129.259 3.024 . . . . 0.0 116.487 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 27.7 m 165.69 115.74 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.901 3.28 . . . . 0.0 104.012 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.446 HG22 ' H ' ' A' ' 114' ' ' SER . 9.5 p -156.81 -176.63 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.446 ' H ' HG22 ' A' ' 113' ' ' VAL . 18.1 m -74.16 61.31 0.84 Allowed 'General case' 0 C--N 1.368 1.409 0 C-N-CA 129.549 3.14 . . . . 0.0 109.925 172.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.357 22.9 m-85 -22.53 137.07 0.01 OUTLIER 'General case' 0 C--N 1.357 0.909 2 N-CA-C 127.217 6.006 . . . . 0.0 127.217 -166.396 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -5.52 46.23 Favored 'General case' 0 C--N 1.36 1.039 1 C-N-CA 134.361 5.064 . . . . 0.0 116.437 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -49.06 -28.66 4.26 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 129.662 3.185 . . . . 0.0 116.97 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.09 -18.96 61.88 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 131.28 3.832 . . . . 0.0 114.78 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.8 t -136.07 7.25 3.15 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 125.346 1.459 . . . . 0.0 110.906 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -140.22 -171.89 3.29 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 119.905 1.23 . . . . 0.0 109.455 -174.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.454 HG22 ' HB1' ' A' ' 95' ' ' ALA 0.269 9.0 mt 82.92 122.46 0.03 OUTLIER Pre-proline 0 C--N 1.374 1.636 0 C-N-CA 129.166 2.987 . . . . 0.0 104.69 -173.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.418 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 11.3 Cg_endo -56.46 125.37 18.83 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 124.544 3.496 . . . . 0.0 120.042 -152.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 1.9 m -30.22 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.372 1.556 1 C-N-CA 133.725 4.81 . . . . 0.0 119.456 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.7 m -71.16 -45.03 64.33 Favored 'General case' 0 C--N 1.357 0.903 0 C-N-CA 127.31 2.244 . . . . 0.0 113.954 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.458 ' H ' HD13 ' A' ' 125' ' ' ILE 0.431 0.0 OUTLIER -70.18 -27.48 32.36 Favored 'Isoleucine or valine' 0 C--N 1.366 1.285 0 C-N-CA 127.1 2.16 . . . . 0.0 112.899 -179.947 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.1 tp -50.77 -26.9 6.22 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 130.329 3.451 . . . . 0.0 114.852 173.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -78.92 -19.9 50.66 Favored 'General case' 0 C--N 1.366 1.312 0 O-C-N 119.769 -1.832 . . . . 0.0 112.729 170.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.311 38.9 tptt -82.15 -13.07 57.73 Favored 'General case' 0 C--N 1.367 1.342 0 C-N-CA 129.891 3.276 . . . . 0.0 113.246 171.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -40.09 72.28 Favored 'General case' 0 N--CA 1.514 2.775 0 C-N-CA 129.055 2.942 . . . . 0.0 112.334 165.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -90.8 -24.8 0.28 Allowed Pre-proline 0 CA--C 1.556 1.194 1 N-CA-C 124.204 4.89 . . . . 0.0 124.204 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -69.16 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.357 1.022 1 CA-C-N 130.887 4.924 . . . . 0.0 120.725 -161.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.332 1.0 OUTLIER -68.02 -56.96 7.0 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 121.526 3.899 . . . . 0.0 121.526 -174.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -148.52 153.7 38.78 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 101.099 -3.667 . . . . 0.0 101.099 -176.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 5.2 mmtp 68.36 -55.66 0.51 Allowed 'General case' 0 C--N 1.354 0.788 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.499 ' HA ' ' HZ1' ' A' ' 68' ' ' LYS 0.347 1.8 mpt? 68.73 -30.5 0.18 Allowed 'General case' 0 C--N 1.359 1.021 0 C-N-CA 131.401 3.88 . . . . 0.0 116.18 177.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -167.28 -176.11 3.16 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 127.754 2.422 . . . . 0.0 105.161 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 174.624 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.5 tp60 . . . . . 0 N--CA 1.44 -0.938 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 83.8 107.84 0.06 Allowed 'General case' 0 C--N 1.363 1.185 0 C-N-CA 129.654 3.182 . . . . 0.0 110.811 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 41' ' ' VAL . 2.5 t -53.63 -44.93 59.29 Favored 'Isoleucine or valine' 0 C--N 1.369 1.454 0 C-N-CA 128.96 2.904 . . . . 0.0 116.959 -171.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.469 0.0 OUTLIER -68.66 -26.13 65.16 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.083 2.553 . . . . 0.0 115.609 172.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -60.9 -25.91 67.06 Favored 'General case' 0 C--N 1.369 1.415 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -68.74 -38.85 80.43 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 126.813 2.045 . . . . 0.0 113.997 175.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.59 -18.73 13.76 Favored 'General case' 0 C--N 1.353 0.761 0 C-N-CA 126.762 2.025 . . . . 0.0 115.901 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.5 m -77.54 -13.65 59.86 Favored 'General case' 0 C--N 1.377 1.802 0 CA-C-N 120.946 1.703 . . . . 0.0 112.92 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -124.52 -54.06 2.33 Favored 'Isoleucine or valine' 0 C--N 1.349 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 109.997 176.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.7 p -101.99 76.52 1.62 Allowed 'General case' 0 C--N 1.363 1.182 0 O-C-N 120.471 -1.393 . . . . 0.0 111.98 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 164.62 -68.64 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 101.236 -3.616 . . . . 0.0 101.236 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.55 149.48 38.91 Favored 'General case' 0 C--N 1.38 1.893 0 C-N-CA 125.706 1.602 . . . . 0.0 112.204 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -41.11 -16.63 0.01 OUTLIER 'General case' 0 C--N 1.355 0.834 1 N-CA-C 123.371 4.582 . . . . 0.0 123.371 -166.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.408 ' CE1' ' SD ' ' A' ' 100' ' ' MET . 0.5 OUTLIER -74.2 -16.92 60.96 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 118.881 -2.387 . . . . 0.0 112.819 178.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HG ' ' A' ' 56' ' ' LEU . 11.2 p-10 -51.43 -43.37 62.01 Favored 'General case' 0 C--N 1.382 1.98 0 C-N-CA 130.173 3.389 . . . . 0.0 115.595 176.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -73.58 -30.93 63.32 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 129.494 3.118 . . . . 0.0 113.186 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -76.39 -48.62 19.21 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 123.4 0.68 . . . . 0.0 110.222 169.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.415 0.2 OUTLIER -63.09 -51.04 68.18 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 179.753 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.381 18.0 p -53.1 -34.66 57.63 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 114.474 -2.679 . . . . 0.0 117.643 171.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -66.76 -32.0 73.0 Favored 'General case' 0 C--N 1.372 1.572 0 CA-C-N 123.618 2.917 . . . . 0.0 117.603 176.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 91.0 mtp -51.09 -42.05 60.39 Favored 'General case' 0 C--N 1.379 1.888 0 C-N-CA 130.065 3.346 . . . . 0.0 111.612 170.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.549 HG13 HD23 ' A' ' 63' ' ' LEU 0.519 10.7 t -76.46 -53.93 1.95 Allowed Pre-proline 0 N--CA 1.437 -1.097 1 CA-C-O 108.279 -5.629 . . . . 0.0 115.026 175.651 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -52.13 -18.2 6.98 Favored 'Trans proline' 0 C--N 1.398 3.159 3 CA-C-N 139.665 8.059 . . . . 0.0 115.929 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.96 -51.67 63.28 Favored 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 120.129 1.331 . . . . 0.0 113.383 159.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.599 HD22 ' HB ' ' A' ' 121' ' ' ILE . 33.2 tp -66.62 -54.58 21.85 Favored 'General case' 0 C--N 1.376 1.721 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 170.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.597 HG21 HG13 ' A' ' 88' ' ' VAL . 11.0 p -72.3 -34.29 48.78 Favored 'Isoleucine or valine' 0 C--N 1.361 1.103 0 O-C-N 117.904 -2.998 . . . . 0.0 113.338 -178.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.607 3.7 mm-40 -78.69 -31.27 46.53 Favored 'General case' 0 C--N 1.37 1.461 0 CA-C-N 120.34 1.427 . . . . 0.0 111.201 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.57 -54.31 39.27 Favored 'General case' 0 C--N 1.397 2.668 0 C-N-CA 125.022 1.329 . . . . 0.0 114.124 165.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.68 -29.33 64.47 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 129.211 3.004 . . . . 0.0 115.723 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.438 0.4 OUTLIER -75.94 -25.24 55.74 Favored 'General case' 0 C--N 1.36 1.052 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 177.768 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . 0.344 2.9 p30 -56.67 -23.31 40.89 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 174.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.349 38.5 tt0 -55.85 -25.59 42.81 Favored 'General case' 0 C--N 1.35 0.604 1 C-N-CA 134.081 4.953 . . . . 0.0 117.362 173.889 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.0 m -105.89 20.17 19.36 Favored 'General case' 0 C--N 1.36 1.048 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -165.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 93.98 -40.16 0.01 OUTLIER 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.83 2.052 . . . . 0.0 114.642 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.449 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -84.25 142.91 41.38 Favored Pre-proline 0 C--N 1.355 0.822 0 C-N-CA 126.281 1.832 . . . . 0.0 115.207 -171.431 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -93.87 -3.74 2.88 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 124.518 3.478 . . . . 0.0 114.113 -176.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.366 6.6 p90 39.69 60.5 1.62 Allowed 'General case' 0 C--N 1.375 1.688 0 C-N-CA 130.301 3.44 . . . . 0.0 118.536 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.1 mm -115.55 145.36 21.39 Favored 'Isoleucine or valine' 0 C--N 1.356 0.868 0 C-N-CA 129.125 2.97 . . . . 0.0 104.517 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -115.67 166.5 11.86 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.033 1.733 . . . . 0.0 109.149 -176.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -45.46 -14.39 0.02 OUTLIER 'General case' 0 C--N 1.365 1.248 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -101.23 -14.29 17.75 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.979 1.712 . . . . 0.0 110.208 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.88 28.5 25.97 Favored Glycine 0 C--N 1.362 2.01 0 C-N-CA 129.356 3.36 . . . . 0.0 112.104 -173.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 36.3 t-20 -99.57 166.04 11.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 128.111 2.564 . . . . 0.0 105.388 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -77.54 152.58 33.98 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.145 2.178 . . . . 0.0 114.173 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t -110.52 130.87 55.46 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 85' ' ' PRO . 33.7 mm -120.58 100.79 46.68 Favored Pre-proline 0 C--N 1.38 1.905 0 O-C-N 119.588 -1.945 . . . . 0.0 114.278 -176.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 84' ' ' ILE . 49.5 Cg_endo -76.95 179.28 6.67 Favored 'Trans proline' 0 C--N 1.364 1.378 1 C-N-CA 127.317 5.345 . . . . 0.0 113.342 170.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.7 p -57.32 -51.38 69.61 Favored 'General case' 0 C--N 1.363 1.178 0 C-N-CA 129.291 3.036 . . . . 0.0 118.688 -174.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.27 -38.69 82.01 Favored Glycine 0 N--CA 1.5 2.933 0 CA-C-O 123.854 1.808 . . . . 0.0 113.917 176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 64' ' ' VAL . 29.8 t -66.92 -32.22 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 127.948 2.499 . . . . 0.0 113.854 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.458 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.3 tp -70.23 -45.24 66.91 Favored 'General case' 0 C--N 1.366 1.306 0 C-N-CA 128.917 2.887 . . . . 0.0 113.812 172.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.391 0.5 OUTLIER -65.04 -26.81 40.86 Favored 'Isoleucine or valine' 0 C--N 1.38 1.916 0 CA-C-O 123.139 1.447 . . . . 0.0 113.244 174.085 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 1.5 t80 -67.02 -58.16 5.47 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 125.525 1.53 . . . . 0.0 112.551 168.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.458 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.323 33.4 m -50.49 -57.88 2.18 Favored 'Isoleucine or valine' 0 C--N 1.383 2.022 0 CA-C-N 120.821 1.646 . . . . 0.0 114.653 -178.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.39 -55.28 26.32 Favored 'General case' 0 C--N 1.356 0.885 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 168.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -75.38 -37.77 60.35 Favored 'General case' 0 C--N 1.374 1.655 0 CA-C-N 121.802 2.092 . . . . 0.0 115.702 -173.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.487 ' HB3' HG21 ' A' ' 60' ' ' VAL . . . -60.9 -48.15 83.14 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 129.745 3.218 . . . . 0.0 114.294 175.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -76.51 -31.59 57.78 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 113.043 -1.89 . . . . 0.0 112.56 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -64.69 -45.84 84.91 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 119.589 1.086 . . . . 0.0 111.382 169.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.71 -43.25 80.49 Favored 'General case' 0 C--N 1.372 1.578 0 CA-C-N 120.555 1.525 . . . . 0.0 114.198 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.449 ' HB2' ' HD2' ' A' ' 122' ' ' PRO . 13.8 t80 -70.81 -44.28 66.91 Favored 'General case' 0 C--N 1.374 1.635 0 O-C-N 118.977 -2.327 . . . . 0.0 116.891 175.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 52' ' ' HIS 0.3 6.0 tmm? -82.42 -28.63 31.23 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 124.839 1.256 . . . . 0.0 112.924 -172.008 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.8 t -60.5 -10.28 4.8 Favored 'General case' 0 C--N 1.381 1.943 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.14 5.66 24.16 Favored 'General case' 0 C--N 1.36 1.037 0 CA-C-N 119.549 1.068 . . . . 0.0 110.829 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.17 12.11 34.24 Favored 'General case' 0 C--N 1.373 1.596 0 CA-C-N 122.036 2.198 . . . . 0.0 114.687 176.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.93 -11.89 69.44 Favored Glycine 0 C--N 1.36 1.903 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 158.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.372 2.5 pp -117.81 -56.62 2.18 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 117.776 2.51 . . . . 0.0 117.776 179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 m -92.28 38.71 1.01 Allowed 'General case' 0 C--N 1.36 1.054 0 C-N-CA 128.678 2.791 . . . . 0.0 107.048 177.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.74 -179.73 30.56 Favored Glycine 0 C--N 1.355 1.61 0 C-N-CA 126.552 2.025 . . . . 0.0 113.646 -161.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -165.51 176.86 7.83 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 119.624 -2.103 . . . . 0.0 105.964 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -72.38 70.98 0.9 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.452 2.301 . . . . 0.0 114.057 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.254 26.4 mmt 104.87 -77.12 0.0 OUTLIER 'General case' 0 C--N 1.357 0.935 0 C-N-CA 131.537 3.935 . . . . 0.0 109.824 -178.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.254 34.3 t70 98.03 71.98 0.0 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 128.699 2.8 . . . . 0.0 107.543 -169.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.324 75.3 m 75.05 -48.93 0.65 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.788 2.835 . . . . 0.0 115.434 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.492 0.5 OUTLIER 106.63 -39.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 130.765 3.626 . . . . 0.0 110.786 178.409 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.1 m -85.2 -11.38 55.08 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 125.686 1.594 . . . . 0.0 112.1 170.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 54.78 -98.82 0.09 Allowed 'General case' 0 C--N 1.372 1.545 0 C-N-CA 130.412 3.485 . . . . 0.0 118.562 175.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -179.38 22.36 0.0 OUTLIER 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.424 -1.716 . . . . 0.0 108.658 -164.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -64.51 -22.93 67.11 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 118.498 2.777 . . . . 0.0 118.498 -165.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.09 -8.48 55.43 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 127.809 2.443 . . . . 0.0 111.497 173.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.8 m -116.84 -40.79 3.11 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 126.409 1.884 . . . . 0.0 113.127 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -114.04 -150.73 0.47 Allowed 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.233 -1.542 . . . . 0.0 111.648 179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.599 ' HB ' HD22 ' A' ' 63' ' ' LEU 0.343 4.6 mt 73.28 123.1 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.539 1 C-N-CA 131.703 4.001 . . . . 0.0 109.605 -170.09 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' ' 125' ' ' ILE . 11.1 Cg_endo -53.77 135.9 63.95 Favored 'Trans proline' 0 C--N 1.373 1.82 1 C-N-CA 126.591 4.861 . . . . 0.0 120.252 -159.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 6.3 m -53.5 -28.5 31.35 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 131.121 3.768 . . . . 0.0 118.844 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.2 t -74.63 -31.42 61.97 Favored 'General case' 0 C--N 1.364 1.2 0 O-C-N 120.977 -1.077 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 125' ' ' ILE 0.547 0.0 OUTLIER -71.67 -26.22 25.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 128.426 2.69 . . . . 0.0 113.686 173.355 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.276 0.4 OUTLIER -51.04 -25.82 5.37 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 118.169 -2.832 . . . . 0.0 115.923 173.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -74.6 -28.07 60.75 Favored 'General case' 0 C--N 1.368 1.378 0 C-N-CA 125.316 1.446 . . . . 0.0 112.173 168.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.259 12.0 mptt -74.76 -13.86 60.64 Favored 'General case' 0 C--N 1.375 1.706 0 C-N-CA 129.08 2.952 . . . . 0.0 112.276 173.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 64' ' ' VAL . 1.0 OUTLIER -60.61 -32.14 71.29 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 119.433 -2.042 . . . . 0.0 114.765 161.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -96.37 -4.11 0.11 Allowed Pre-proline 0 CA--C 1.557 1.231 1 N-CA-C 122.59 4.292 . . . . 0.0 122.59 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -74.06 -10.9 23.14 Favored 'Trans proline' 0 C--N 1.365 1.401 2 CA-C-N 133.556 5.877 . . . . 0.0 114.697 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -98.13 -87.05 0.34 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 128.458 2.703 . . . . 0.0 107.101 176.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.29 13.1 mtp180 74.87 -69.12 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.17 1.788 . . . . 0.0 114.661 -175.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -171.72 35.18 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 174.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.0 ppp? -68.09 -19.24 64.84 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.102 2.26 . . . . 0.0 117.102 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -120.89 115.43 23.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 126.784 2.034 . . . . 0.0 108.178 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 . . . . . 0 C--N 1.359 1.018 0 C-N-CA 125.274 1.43 . . . . 0.0 112.265 -178.622 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.947 0 CA-C-O 121.955 0.883 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -115.36 125.04 52.72 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 126.301 1.84 . . . . 0.0 106.282 177.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.25 27.6 m -61.92 -34.06 61.05 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 C-N-CA 128.244 2.618 . . . . 0.0 115.551 -178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -67.98 -28.18 67.22 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.791 2.436 . . . . 0.0 113.077 172.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -58.76 -26.33 63.9 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 126.921 2.088 . . . . 0.0 116.043 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 91.3 mt -71.9 -49.77 34.99 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 127.017 2.127 . . . . 0.0 113.431 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.429 ' HB3' HD22 ' A' ' 49' ' ' ASN . 0.1 OUTLIER -87.99 -17.91 30.19 Favored 'General case' 0 C--N 1.351 0.636 0 C-N-CA 128.643 2.777 . . . . 0.0 113.268 177.401 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.9 t -69.64 -19.99 63.61 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.033 2.133 . . . . 0.0 110.518 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.271 1.1 mt -123.41 -53.44 2.67 Favored 'Isoleucine or valine' 0 C--N 1.362 1.114 0 C-N-CA 124.993 1.317 . . . . 0.0 112.941 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.6 m -100.94 85.84 2.94 Favored 'General case' 0 C--N 1.368 1.372 0 CA-C-N 121.238 1.835 . . . . 0.0 108.627 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.429 HD22 ' HB3' ' A' ' 45' ' ' LEU . 42.0 m-20 156.38 -62.14 0.0 OUTLIER 'General case' 0 C--N 1.357 0.922 0 C-N-CA 130.153 3.381 . . . . 0.0 103.654 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.37 158.74 19.76 Favored 'General case' 0 C--N 1.377 1.804 0 O-C-N 120.796 -1.19 . . . . 0.0 113.493 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -42.03 -28.11 0.16 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 121.268 3.803 . . . . 0.0 121.268 -172.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -59.76 -21.68 61.07 Favored 'General case' 0 C--N 1.358 0.947 1 C-N-CA 132.104 4.162 . . . . 0.0 113.074 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 55.2 p-10 -52.95 -34.77 57.12 Favored 'General case' 0 C--N 1.375 1.701 0 C-N-CA 128.546 2.738 . . . . 0.0 114.413 174.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.83 -34.01 66.55 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 125.475 1.51 . . . . 0.0 113.395 171.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -76.32 -39.56 53.73 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 125.341 1.456 . . . . 0.0 111.669 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.52 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -68.99 -49.82 54.46 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.274 1.83 . . . . 0.0 113.175 173.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 92' ' ' VAL 0.433 41.0 p -58.29 -34.13 70.21 Favored 'General case' 0 C--N 1.365 1.262 0 CA-C-O 115.511 -2.185 . . . . 0.0 116.755 173.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -65.36 -31.34 72.4 Favored 'General case' 0 C--N 1.372 1.567 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 173.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.1 mtp -52.47 -44.04 65.34 Favored 'General case' 0 C--N 1.377 1.782 0 CA-C-O 126.949 3.262 . . . . 0.0 112.487 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.501 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.463 2.1 t -71.14 -51.23 10.63 Favored Pre-proline 0 C--O 1.213 -0.834 1 CA-C-O 111.646 -4.026 . . . . 0.0 114.856 179.079 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 51.2 Cg_exo -54.38 -19.45 17.31 Favored 'Trans proline' 0 C--N 1.377 2.038 1 CA-C-N 133.396 5.82 . . . . 0.0 115.724 163.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 34.8 mt -60.05 -38.68 83.49 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-N 123.541 2.882 . . . . 0.0 111.294 162.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 16.5 tp -75.65 -54.11 7.49 Favored 'General case' 0 C--N 1.373 1.615 0 N-CA-C 117.865 2.542 . . . . 0.0 117.865 167.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.463 HG23 HG12 ' A' ' 60' ' ' VAL . 14.9 t -64.12 -32.51 57.63 Favored 'Isoleucine or valine' 0 C--N 1.366 1.29 0 C-N-CA 130.2 3.4 . . . . 0.0 113.952 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.367 34.8 tt0 -77.17 -49.0 16.14 Favored 'General case' 0 C--N 1.371 1.521 0 CA-C-O 116.56 -1.686 . . . . 0.0 110.074 171.16 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -53.68 -52.99 58.25 Favored 'General case' 0 C--N 1.395 2.564 0 CA-C-N 123.061 2.664 . . . . 0.0 114.883 173.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.82 4.63 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 128.879 2.871 . . . . 0.0 114.13 -177.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.73 15.8 tptt -76.63 -22.34 54.27 Favored 'General case' 0 C--N 1.367 1.344 0 N-CA-C 119.636 3.199 . . . . 0.0 119.636 178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -54.8 -22.64 14.98 Favored 'General case' 0 C--N 1.386 2.183 0 O-C-N 118.741 -2.475 . . . . 0.0 113.639 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -42.38 88.03 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.267 3.027 . . . . 0.0 113.407 175.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.22 1.37 32.93 Favored 'General case' 0 C--N 1.375 1.703 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -175.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 55.56 43.17 28.8 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 131.452 3.901 . . . . 0.0 118.576 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . 0.392 0.0 OUTLIER -69.59 173.94 3.52 Favored Pre-proline 0 C--N 1.368 1.378 0 C-N-CA 125.863 1.665 . . . . 0.0 114.343 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -95.24 54.39 0.21 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 128.235 3.977 . . . . 0.0 107.62 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -88.89 18.18 5.04 Favored 'General case' 0 C--N 1.364 1.221 0 C-N-CA 128.19 2.596 . . . . 0.0 108.905 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -112.64 154.31 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 1 C-N-CA 132.515 4.326 . . . . 0.0 108.561 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -115.49 163.64 15.45 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.122 1.769 . . . . 0.0 109.005 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.29 -11.76 1.98 Allowed 'General case' 0 C--N 1.372 1.558 0 C-N-CA 128.926 2.89 . . . . 0.0 118.098 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -97.95 -8.78 27.38 Favored 'General case' 0 C--N 1.359 0.982 0 C-N-CA 126.606 1.962 . . . . 0.0 110.128 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.44 32.4 Favored Glycine 0 C--N 1.36 1.914 0 C-N-CA 129.555 3.455 . . . . 0.0 112.935 -175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -98.51 -171.84 2.21 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 127.402 2.281 . . . . 0.0 107.749 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -94.11 153.28 18.2 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 125.227 1.411 . . . . 0.0 111.428 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.3 t -155.91 156.71 35.06 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.5 132.6 13.32 Favored Pre-proline 0 C--N 1.358 0.945 0 CA-C-N 120.554 1.525 . . . . 0.0 111.037 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.3 169.03 21.73 Favored 'Trans proline' 0 C--N 1.367 1.549 0 C-N-CA 125.112 3.875 . . . . 0.0 111.796 167.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.11 -35.94 12.36 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 120.678 3.585 . . . . 0.0 120.678 -172.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.7 -44.24 21.03 Favored Glycine 0 N--CA 1.496 2.687 0 O-C-N 120.536 -1.353 . . . . 0.0 114.775 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.432 ' O ' HG13 ' A' ' 92' ' ' VAL 0.508 10.1 m -75.49 -22.32 16.4 Favored 'Isoleucine or valine' 0 C--N 1.363 1.172 0 O-C-N 119.733 -2.04 . . . . 0.0 112.643 176.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.26 -41.38 73.56 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.241 2.216 . . . . 0.0 113.589 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.29 12.2 pt -67.37 -28.79 43.52 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 119.414 -2.053 . . . . 0.0 112.513 170.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -64.48 -50.13 68.67 Favored 'General case' 0 C--N 1.373 1.599 0 CA-C-O 115.95 -1.976 . . . . 0.0 110.01 169.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.591 HG23 HG22 ' A' ' 57' ' ' THR 0.42 6.7 m -51.02 -56.04 5.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.146 0 CA-C-N 122.122 2.237 . . . . 0.0 114.669 177.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.499 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.03 -58.03 7.13 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 128.006 2.522 . . . . 0.0 116.727 169.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.393 58.4 mmtt -75.85 -31.4 59.29 Favored 'General case' 0 C--N 1.374 1.662 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 -177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.78 -53.69 46.9 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 129.26 3.024 . . . . 0.0 113.894 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.262 . . -78.04 -35.42 49.75 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 112.751 -2.022 . . . . 0.0 112.85 177.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HB3' HD11 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -61.64 -30.92 71.02 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 124.149 3.159 . . . . 0.0 114.121 172.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -50.62 23.01 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.042 1.337 . . . . 0.0 112.082 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.08 -45.38 63.86 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.491 2.404 . . . . 0.0 117.491 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -28.81 68.15 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 130.543 3.537 . . . . 0.0 115.992 -171.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 3.2 t -71.97 -35.74 69.62 Favored 'General case' 0 C--N 1.36 1.039 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 162.77 60.5 0.0 OUTLIER 'General case' 0 C--N 1.367 1.361 0 C-N-CA 128.905 2.882 . . . . 0.0 109.718 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.98 26.5 9.18 Favored 'General case' 0 C--N 1.37 1.464 0 O-C-N 119.606 -1.934 . . . . 0.0 112.353 173.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 101.65 20.75 12.42 Favored Glycine 0 C--N 1.365 2.144 0 O-C-N 120.964 -1.085 . . . . 0.0 113.904 176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 105' ' ' LEU . 2.4 pt? -88.43 -59.24 2.29 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.364 1.865 . . . . 0.0 112.14 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.467 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 4.1 m -86.73 7.55 26.28 Favored 'General case' 0 C--N 1.381 1.953 0 C-N-CA 129.209 3.003 . . . . 0.0 108.932 176.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.97 -5.78 52.95 Favored Glycine 0 N--CA 1.416 -2.644 1 C-N-CA 130.806 4.05 . . . . 0.0 113.683 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.9 ttt-85 -168.23 -39.62 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 CA-C-N 120.318 2.059 . . . . 0.0 112.186 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.5 m -112.32 -176.29 2.88 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 125.124 1.37 . . . . 0.0 107.862 -178.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 11.2 ttm -106.97 -129.41 0.28 Allowed 'General case' 0 C--N 1.358 0.944 0 O-C-N 120.375 -1.453 . . . . 0.0 114.257 -174.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.38 79.99 1.4 Allowed 'General case' 0 C--N 1.358 0.967 0 C-N-CA 127.033 2.133 . . . . 0.0 110.579 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.343 75.3 p 77.61 55.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 127.138 2.175 . . . . 0.0 114.531 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 59.8 t -116.23 66.26 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.981 0 N-CA-C 103.164 -2.902 . . . . 0.0 103.164 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.3 67.1 m 62.41 -48.02 0.18 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 130.21 3.404 . . . . 0.0 115.575 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 74.95 -92.06 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.483 3.113 . . . . 0.0 113.861 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -173.31 14.05 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 112.414 -2.175 . . . . 0.0 115.138 -166.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -72.79 -7.04 48.8 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.115 -2.865 . . . . 0.0 116.057 -170.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.4 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . . . -88.91 -16.12 32.67 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 129.625 3.17 . . . . 0.0 112.847 169.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.4 t -136.7 -22.23 1.26 Allowed 'General case' 0 C--N 1.363 1.158 0 N-CA-C 116.328 1.974 . . . . 0.0 116.328 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -116.48 -145.4 0.39 Allowed 'General case' 0 C--N 1.362 1.109 0 CA-C-N 121.092 1.769 . . . . 0.0 111.791 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.347 14.0 mm 76.71 128.04 0.03 OUTLIER Pre-proline 0 C--N 1.375 1.716 1 C-N-CA 132.276 4.231 . . . . 0.0 107.821 -169.502 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.28 121.65 9.8 Favored 'Trans proline' 0 C--N 1.375 1.951 1 C-N-CA 126.203 4.602 . . . . 0.0 119.849 -154.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 m -23.84 -50.03 0.02 OUTLIER 'General case' 0 C--N 1.367 1.35 1 C-N-CA 131.951 4.1 . . . . 0.0 120.826 -177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.258 1.7 t -67.33 -36.14 80.85 Favored 'General case' 0 C--N 1.371 1.514 0 C-N-CA 125.38 1.472 . . . . 0.0 114.122 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.558 ' H ' HD13 ' A' ' 125' ' ' ILE 0.647 0.0 OUTLIER -71.33 -26.86 27.5 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 C-N-CA 128.243 2.617 . . . . 0.0 114.38 172.753 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -27.09 62.13 Favored 'General case' 0 C--N 1.364 1.216 0 O-C-N 118.069 -2.894 . . . . 0.0 114.459 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -79.68 -20.01 47.59 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 127.811 2.445 . . . . 0.0 111.517 171.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.268 12.3 ttmm -82.52 -13.7 56.2 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.205 3.002 . . . . 0.0 111.348 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.09 -29.42 70.8 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.536 -1.353 . . . . 0.0 111.519 161.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.63 -22.59 0.39 Allowed Pre-proline 0 CA--C 1.558 1.267 1 N-CA-C 121.9 4.037 . . . . 0.0 121.9 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -67.0 -7.08 17.58 Favored 'Trans proline' 0 CA--C 1.551 1.369 2 C-N-CA 126.152 4.568 . . . . 0.0 119.815 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -142.85 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.199 1 C-N-CA 131.725 4.01 . . . . 0.0 120.196 -175.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 ttp180 -102.85 155.69 18.17 Favored 'General case' 0 C--N 1.371 1.512 0 O-C-N 119.237 -2.164 . . . . 0.0 105.923 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.368 42.4 mmtm 75.97 32.92 0.62 Allowed 'General case' 0 C--N 1.353 0.742 0 C-N-CA 127.032 2.133 . . . . 0.0 116.459 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 89.0 mtp -76.28 -19.84 57.92 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 127.347 2.259 . . . . 0.0 113.089 174.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -99.49 -36.0 9.7 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 126.09 1.756 . . . . 0.0 114.583 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--N 1.362 1.124 0 O-C-N 120.702 -1.249 . . . . 0.0 111.601 -176.115 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -108.85 117.09 33.28 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.9 t -55.37 -35.5 37.27 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 129.531 3.132 . . . . 0.0 115.224 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.3 -27.64 66.48 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.785 2.834 . . . . 0.0 113.095 172.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.325 21.9 ttp180 -56.93 -24.71 54.51 Favored 'General case' 0 C--N 1.364 1.209 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 tp -77.55 -50.04 13.4 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.843 2.057 . . . . 0.0 112.798 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 pp -87.57 -17.67 31.48 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 128.159 2.583 . . . . 0.0 115.701 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 p -73.78 -1.66 20.23 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 126.417 1.887 . . . . 0.0 113.486 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.49 HG13 ' H ' ' A' ' 48' ' ' THR . 1.0 OUTLIER -127.02 -76.41 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.791 0 C-N-CA 128.804 2.841 . . . . 0.0 110.434 175.14 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.49 ' H ' HG13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER -83.37 76.29 9.92 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 130.725 3.61 . . . . 0.0 110.22 178.748 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.268 23.5 m-80 158.64 -57.39 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 129.175 2.99 . . . . 0.0 103.425 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -59.96 -150.96 0.0 OUTLIER 'General case' 0 C--N 1.38 1.91 0 N-CA-C 115.883 1.808 . . . . 0.0 115.883 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -87.14 -20.4 27.1 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 117.503 -3.248 . . . . 0.0 117.58 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -78.39 -10.8 59.84 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 128.151 2.58 . . . . 0.0 114.204 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -49.29 -44.75 44.32 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 131.037 3.735 . . . . 0.0 114.14 177.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.53 -40.22 66.92 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 127.651 2.38 . . . . 0.0 114.029 170.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -71.86 -39.16 69.87 Favored 'General case' 0 C--N 1.372 1.563 0 O-C-N 120.341 -1.474 . . . . 0.0 114.243 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.67 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.449 0.0 OUTLIER -71.25 -46.3 61.32 Favored 'General case' 0 C--N 1.371 1.528 0 CA-C-N 120.196 1.362 . . . . 0.0 112.003 172.594 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.448 ' H ' HD23 ' A' ' 56' ' ' LEU 0.519 80.4 p -52.32 -32.57 38.51 Favored 'General case' 0 C--N 1.36 1.064 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 167.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.46 -41.91 92.88 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 123.294 2.77 . . . . 0.0 117.204 173.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.457 ' HE3' ' HG3' ' A' ' 120' ' ' GLU 0.254 11.2 mtp -44.4 -50.42 9.24 Favored 'General case' 0 C--N 1.389 2.301 0 CA-C-O 127.025 3.298 . . . . 0.0 112.725 175.256 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.705 HG13 HD23 ' A' ' 63' ' ' LEU 0.462 0.7 OUTLIER -66.99 -59.98 6.83 Favored Pre-proline 0 C--O 1.209 -1.064 1 CA-C-O 109.298 -5.144 . . . . 0.0 113.825 -178.511 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.2 Cg_exo -53.29 -15.59 5.79 Favored 'Trans proline' 0 C--N 1.376 1.994 2 CA-C-N 134.383 6.173 . . . . 0.0 116.172 168.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.01 -41.12 87.2 Favored 'General case' 0 CA--C 1.573 1.851 0 CA-C-N 122.705 2.502 . . . . 0.0 112.925 160.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -71.13 -49.47 43.77 Favored 'General case' 0 C--N 1.368 1.382 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 166.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.527 HG23 HG12 ' A' ' 60' ' ' VAL . 21.9 t -60.73 -29.7 45.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.455 0 O-C-N 117.896 -3.003 . . . . 0.0 110.96 174.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.455 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.37 9.6 pt-20 -70.54 -48.56 54.89 Favored 'General case' 0 C--N 1.367 1.369 0 O-C-N 119.231 -2.168 . . . . 0.0 111.153 172.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -54.65 44.57 Favored 'General case' 0 C--N 1.383 2.047 0 N-CA-C 116.018 1.858 . . . . 0.0 116.018 173.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HB1' HD11 ' A' ' 129' ' ' LEU . . . -71.11 -42.47 69.21 Favored 'General case' 0 C--N 1.349 0.576 0 C-N-CA 131.269 3.828 . . . . 0.0 115.574 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' A' ' 68' ' ' LYS 0.388 0.0 OUTLIER -75.58 -24.65 56.63 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 116.217 1.932 . . . . 0.0 116.217 179.248 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -55.23 -23.84 24.51 Favored 'General case' 0 C--N 1.387 2.236 0 C-N-CA 126.517 1.927 . . . . 0.0 115.142 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.301 15.5 tp10 -57.04 -24.63 55.13 Favored 'General case' 0 N--CA 1.438 -1.037 1 C-N-CA 134.88 5.272 . . . . 0.0 117.969 172.509 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.8 m -114.61 21.05 14.84 Favored 'General case' 0 C--N 1.366 1.323 0 N-CA-C 118.696 2.85 . . . . 0.0 118.696 -165.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.286 30.0 m-70 106.39 -42.34 0.0 OUTLIER 'General case' 0 C--N 1.358 0.96 0 C-N-CA 127.427 2.291 . . . . 0.0 114.071 176.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.501 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -85.1 137.91 37.17 Favored Pre-proline 0 C--N 1.36 1.059 0 C-N-CA 125.096 1.359 . . . . 0.0 113.243 -174.058 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -88.31 -12.67 3.85 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.468 2.779 . . . . 0.0 113.101 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.476 6.0 p90 38.42 -8.12 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 1 C-N-CA 133.14 4.576 . . . . 0.0 121.49 -179.648 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 61.5 mt -83.45 151.49 3.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 130.387 3.475 . . . . 0.0 109.336 177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -114.92 167.29 10.92 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 120.119 -1.613 . . . . 0.0 111.357 -173.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -42.89 -21.66 0.02 OUTLIER 'General case' 0 C--N 1.365 1.277 0 N-CA-C 121.672 3.953 . . . . 0.0 121.672 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -102.59 -5.81 23.48 Favored 'General case' 0 C--N 1.364 1.233 0 O-C-N 120.195 -1.566 . . . . 0.0 109.692 178.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.23 33.52 20.07 Favored Glycine 0 C--N 1.362 1.992 0 C-N-CA 130.462 3.887 . . . . 0.0 112.582 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -93.91 158.43 15.65 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 125.939 1.696 . . . . 0.0 109.272 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.06 152.52 19.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.374 2.67 . . . . 0.0 110.835 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.7 t -158.67 136.72 10.58 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' VAL . 0.5 OUTLIER -142.18 139.15 17.46 Favored Pre-proline 0 C--N 1.359 1.017 0 CA-C-O 116.956 -1.497 . . . . 0.0 109.109 -177.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 179.64 6.2 Favored 'Trans proline' 0 C--N 1.361 1.219 0 C-N-CA 125.258 3.972 . . . . 0.0 113.391 167.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -48.78 -42.19 34.94 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 120.234 3.42 . . . . 0.0 120.234 -174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.68 -50.73 18.53 Favored Glycine 0 N--CA 1.497 2.747 0 C-N-CA 124.869 1.223 . . . . 0.0 114.53 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG23 ' A' ' 92' ' ' VAL 0.261 0.0 OUTLIER -66.45 -25.53 35.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.383 0 O-C-N 119.577 -2.131 . . . . 0.0 112.606 176.698 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.9 tp -69.75 -39.28 76.83 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 128.386 2.674 . . . . 0.0 114.412 171.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.293 0.5 OUTLIER -66.33 -30.56 50.24 Favored 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 120.007 1.276 . . . . 0.0 112.447 172.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -65.09 -58.68 5.41 Favored 'General case' 0 C--N 1.374 1.673 0 C-N-CA 124.371 1.068 . . . . 0.0 110.583 166.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 88' ' ' VAL . 27.2 t -50.88 -62.2 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.04 0 C-N-CA 129.025 2.93 . . . . 0.0 115.671 -177.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.29 -47.87 84.18 Favored 'General case' 0 C--N 1.36 1.041 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.397 33.8 mtmt -74.77 -32.39 62.04 Favored 'General case' 0 C--N 1.384 2.084 0 CA-C-N 122.029 2.195 . . . . 0.0 115.926 -178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.75 -47.24 86.47 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.661 2.384 . . . . 0.0 114.065 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.67 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.84 -31.29 45.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 C-N-CA 126.865 2.066 . . . . 0.0 114.637 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.342 0.0 OUTLIER -71.97 -22.73 61.4 Favored 'General case' 0 C--N 1.377 1.793 0 CA-C-N 120.145 1.339 . . . . 0.0 111.901 170.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -73.54 -57.01 4.3 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.011 1.324 . . . . 0.0 112.011 168.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.272 2.6 t80 -72.12 -51.16 22.72 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 120.834 3.642 . . . . 0.0 120.834 -178.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -57.46 -28.88 63.75 Favored 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.923 2.489 . . . . 0.0 114.303 -173.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.1 m -54.28 -24.14 17.8 Favored 'General case' 0 C--N 1.354 0.79 1 C-N-CA 134.356 5.062 . . . . 0.0 114.407 169.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.251 0.7 OUTLIER -104.62 8.28 35.23 Favored 'General case' 0 C--N 1.369 1.42 0 O-C-N 120.457 -1.402 . . . . 0.0 111.45 172.338 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.25 22.45 12.42 Favored 'General case' 0 C--N 1.37 1.477 0 O-C-N 118.827 -2.42 . . . . 0.0 115.828 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.76 -12.7 63.85 Favored Glycine 0 C--N 1.356 1.681 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 153.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.373 4.0 pp -117.96 -53.75 2.36 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 118.643 2.831 . . . . 0.0 118.643 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -102.32 37.94 1.79 Allowed 'General case' 0 C--N 1.363 1.183 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -85.16 -177.9 50.83 Favored Glycine 0 C--N 1.352 1.472 0 C-N-CA 129.794 3.568 . . . . 0.0 114.633 -172.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.57 157.62 39.99 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -91.61 56.2 2.94 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 125.47 1.508 . . . . 0.0 110.185 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.256 65.9 mtt 72.42 -37.89 0.4 Allowed 'General case' 0 C--N 1.358 0.941 0 C-N-CA 130.14 3.376 . . . . 0.0 113.921 -173.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 80.51 -90.76 0.02 OUTLIER 'General case' 0 C--N 1.362 1.148 0 C-N-CA 130.41 3.484 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.1 t -122.16 6.02 9.74 Favored 'General case' 0 C--N 1.349 0.58 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.453 0.3 OUTLIER 92.87 -34.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.373 0 C-N-CA 129.466 3.106 . . . . 0.0 112.43 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 74.9 m -102.46 85.6 2.64 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 127.231 2.213 . . . . 0.0 105.641 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.314 0.1 OUTLIER -74.3 -66.0 0.78 Allowed 'General case' 0 C--N 1.367 1.366 0 N-CA-C 119.059 2.985 . . . . 0.0 119.059 -169.624 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -172.02 58.36 0.03 OUTLIER 'General case' 0 C--N 1.362 1.138 0 O-C-N 120.328 -1.483 . . . . 0.0 113.71 -170.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.47 52.3 m-85 -61.93 -10.77 10.39 Favored 'General case' 0 N--CA 1.478 0.952 1 N-CA-C 123.131 4.493 . . . . 0.0 123.131 -165.986 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.19 -20.26 55.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.657 1.983 . . . . 0.0 114.025 169.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.1 m -128.66 18.32 6.27 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 120.377 -1.452 . . . . 0.0 111.554 -176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.457 ' HG3' ' HE3' ' A' ' 59' ' ' MET . 3.9 tp10 -104.51 -1.1 27.07 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 115.78 1.77 . . . . 0.0 115.78 -173.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -139.81 162.49 50.46 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-O 117.52 -1.228 . . . . 0.0 108.706 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.495 ' HG2' HG12 ' A' ' 125' ' ' ILE . 93.8 Cg_endo -73.49 152.9 49.45 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 124.474 3.449 . . . . 0.0 115.568 177.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -61.01 -24.55 66.25 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 129.962 3.305 . . . . 0.0 116.228 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 76.0 m -70.54 -57.34 4.86 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 128.613 2.765 . . . . 0.0 114.045 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.401 0.0 OUTLIER -70.7 -27.69 31.64 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 CA-C-O 123.832 1.777 . . . . 0.0 112.978 179.477 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.1 tp -51.91 -26.96 11.44 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 130.275 3.43 . . . . 0.0 115.083 173.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -74.62 -25.46 59.25 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.958 2.503 . . . . 0.0 112.148 170.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 -14.28 51.21 Favored 'General case' 0 C--N 1.371 1.535 0 C-N-CA 130.14 3.376 . . . . 0.0 112.043 174.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 64' ' ' VAL . 2.5 tm? -55.81 -42.55 75.82 Favored 'General case' 0 N--CA 1.511 2.617 0 C-N-CA 126.805 2.042 . . . . 0.0 113.453 168.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -77.92 -43.9 2.32 Favored Pre-proline 0 C--N 1.357 0.909 0 N-CA-C 117.355 2.354 . . . . 0.0 117.355 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_exo -49.88 -7.85 0.1 Allowed 'Trans proline' 0 C--N 1.374 1.869 1 C-N-CA 129.137 6.558 . . . . 0.0 118.979 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -82.0 -86.66 0.1 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 165.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.477 0.0 OUTLIER 79.45 -55.11 0.42 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.605 1.562 . . . . 0.0 111.619 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.335 10.0 pttt 123.92 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.353 0.755 1 C-N-CA 132.675 4.39 . . . . 0.0 109.069 173.231 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 12.4 ptp 46.3 -45.62 0.0 OUTLIER 'General case' 0 C--N 1.359 1.001 2 N-CA-C 122.539 4.274 . . . . 0.0 122.539 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 84.91 6.4 0.51 Allowed 'General case' 0 C--N 1.361 1.103 0 C-N-CA 129.664 3.186 . . . . 0.0 111.947 -173.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 . . . . . 0 C--N 1.361 1.071 0 C-N-CA 126.221 1.808 . . . . 0.0 111.137 -176.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 . . . . . 0 N--CA 1.441 -0.896 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -85.84 -12.42 50.83 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 126.9 2.08 . . . . 0.0 116.029 -174.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.33 -40.71 78.12 Favored 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 126.186 1.794 . . . . 0.0 112.619 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -68.68 -28.94 67.31 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 126.862 2.065 . . . . 0.0 115.196 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -57.02 -25.37 58.45 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 116.838 2.162 . . . . 0.0 116.838 -176.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mp -78.17 -50.61 11.63 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 125.748 1.619 . . . . 0.0 113.083 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 1.4 pp -84.04 -18.41 37.12 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.234 1.814 . . . . 0.0 114.414 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -76.8 -8.35 57.15 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 126.948 2.099 . . . . 0.0 110.478 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.292 4.1 pt -125.47 -62.16 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.317 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 177.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . 0.251 4.7 t -101.96 65.43 0.99 Allowed 'General case' 0 C--N 1.361 1.087 0 C-N-CA 126.399 1.88 . . . . 0.0 107.341 -173.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 177.94 -60.01 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 128.782 2.833 . . . . 0.0 105.487 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -68.28 -159.37 0.02 OUTLIER 'General case' 0 C--N 1.379 1.873 0 C-N-CA 125.415 1.486 . . . . 0.0 113.344 168.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -86.45 -22.73 26.34 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 117.993 -2.942 . . . . 0.0 116.743 -170.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' CD2' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -60.5 -11.0 5.74 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 129.656 3.182 . . . . 0.0 117.465 -176.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -61.95 -35.8 79.52 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 126.393 1.877 . . . . 0.0 113.161 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -73.43 -48.77 31.06 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 128.377 2.671 . . . . 0.0 113.334 175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.442 ' CD2' ' CE1' ' A' ' 52' ' ' HIS . 2.1 t80 -68.02 -38.81 83.0 Favored 'General case' 0 C--N 1.371 1.513 0 C-N-CA 126.261 1.824 . . . . 0.0 111.98 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 96' ' ' ALA 0.448 0.0 OUTLIER -72.98 -52.16 15.55 Favored 'General case' 0 C--N 1.37 1.488 0 O-C-N 120.362 -1.461 . . . . 0.0 114.565 172.11 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.441 HG22 HG12 ' A' ' 92' ' ' VAL 0.579 41.4 p -57.48 -34.35 68.94 Favored 'General case' 0 C--N 1.361 1.079 0 N-CA-C 119.577 3.176 . . . . 0.0 119.577 173.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -68.11 -33.92 75.42 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 125.403 3.729 . . . . 0.0 118.281 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 mtm -61.18 -33.94 74.26 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 128.276 2.63 . . . . 0.0 112.862 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.442 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.613 0.6 OUTLIER -76.48 -47.01 3.31 Favored Pre-proline 0 C--O 1.209 -1.05 1 CA-C-O 109.495 -5.05 . . . . 0.0 114.109 176.772 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.407 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 30.5 Cg_exo -54.13 -17.36 11.27 Favored 'Trans proline' 0 C--N 1.379 2.157 1 CA-C-N 136.974 7.098 . . . . 0.0 115.376 159.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.1 mp -61.38 -39.57 91.14 Favored 'General case' 0 CA--C 1.578 2.034 0 CA-C-N 123.88 3.037 . . . . 0.0 113.583 159.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 117' ' ' PHE . 14.0 tp -75.15 -49.36 19.79 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 169.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.407 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 83.3 t -66.2 -33.36 62.98 Favored 'Isoleucine or valine' 0 C--N 1.365 1.253 0 C-N-CA 130.783 3.633 . . . . 0.0 112.543 176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.274 28.8 tt0 -75.33 -45.4 39.81 Favored 'General case' 0 C--N 1.361 1.068 0 O-C-N 119.168 -2.208 . . . . 0.0 109.361 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -54.47 46.58 Favored 'General case' 0 C--N 1.39 2.339 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 171.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.07 -42.02 69.95 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.892 3.677 . . . . 0.0 116.763 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.359 1.9 ttpt -76.69 -25.06 53.23 Favored 'General case' 0 C--N 1.362 1.129 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -54.22 -22.69 12.2 Favored 'General case' 0 C--N 1.384 2.085 0 C-N-CA 128.901 2.88 . . . . 0.0 114.365 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.292 13.9 tp10 -66.73 -30.48 70.72 Favored 'General case' 0 N--CA 1.446 -0.625 1 C-N-CA 131.909 4.084 . . . . 0.0 113.944 171.691 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.74 3.16 20.59 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -169.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.316 62.2 m80 62.49 59.71 1.48 Allowed 'General case' 0 C--N 1.36 1.029 0 C-N-CA 129.03 2.932 . . . . 0.0 117.167 -174.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.468 HD21 ' CB ' ' A' ' 134' ' ' LYS . 4.8 m-80 -107.54 154.38 40.79 Favored Pre-proline 0 C--N 1.351 0.674 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -85.73 59.13 4.78 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 124.964 3.776 . . . . 0.0 109.506 175.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -85.61 26.01 1.0 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.199 1.799 . . . . 0.0 111.225 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 39.3 mt -130.44 146.07 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 131.124 3.77 . . . . 0.0 104.684 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -105.46 170.24 8.0 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 126.036 1.734 . . . . 0.0 108.7 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.58 -1.76 1.38 Allowed 'General case' 0 C--N 1.366 1.317 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -103.69 -6.53 21.47 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.97 2.508 . . . . 0.0 109.401 175.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.94 26.43 66.81 Favored Glycine 0 C--N 1.367 2.303 0 C-N-CA 129.265 3.317 . . . . 0.0 114.979 -176.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -101.87 162.71 12.7 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 127.824 2.45 . . . . 0.0 106.122 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.34 147.94 50.38 Favored 'General case' 0 C--N 1.353 0.752 0 C-N-CA 127.046 2.138 . . . . 0.0 116.745 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -148.72 144.67 27.23 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -141.77 133.55 13.52 Favored Pre-proline 0 C--N 1.357 0.928 0 CA-C-N 120.958 1.708 . . . . 0.0 110.309 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.78 164.38 25.53 Favored 'Trans proline' 0 C--N 1.37 1.669 1 C-N-CA 125.887 4.391 . . . . 0.0 112.205 171.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -48.8 -35.99 15.65 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 121.453 3.872 . . . . 0.0 121.453 -174.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.16 -47.91 10.41 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.141 -1.599 . . . . 0.0 113.127 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -67.81 -23.92 30.02 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 O-C-N 119.416 -2.226 . . . . 0.0 110.782 175.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -69.99 -36.07 74.88 Favored 'General case' 0 C--N 1.372 1.576 0 C-N-CA 129.044 2.938 . . . . 0.0 112.586 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.453 0.1 OUTLIER -64.32 -37.27 79.5 Favored 'Isoleucine or valine' 0 C--N 1.395 2.549 0 CA-C-N 121.327 1.876 . . . . 0.0 111.735 170.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' A' ' 129' ' ' LEU . 52.1 t80 -58.44 -50.66 72.92 Favored 'General case' 0 C--N 1.383 2.022 0 C-N-CA 125.764 1.626 . . . . 0.0 112.228 166.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.442 ' HA ' HG11 ' A' ' 60' ' ' VAL . 20.7 t -54.81 -62.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 128.92 2.888 . . . . 0.0 113.882 176.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.421 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.18 -48.45 61.93 Favored 'General case' 0 C--N 1.359 1.003 0 C-N-CA 127.849 2.46 . . . . 0.0 116.416 168.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.533 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.595 0.0 OUTLIER -76.44 -30.72 57.48 Favored 'General case' 0 C--N 1.373 1.613 0 N-CA-C 118.167 2.654 . . . . 0.0 118.167 177.529 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 121' ' ' ILE . . . -58.24 -57.17 14.06 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 129.071 2.948 . . . . 0.0 113.777 173.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 56' ' ' LEU 0.387 . . -79.03 -29.12 43.4 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.079 0.952 . . . . 0.0 113.103 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 3.5 pt20 -66.11 -23.4 66.49 Favored 'General case' 0 C--N 1.374 1.639 0 O-C-N 119.347 -2.096 . . . . 0.0 114.369 171.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.22 -55.44 6.44 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.168 0.987 . . . . 0.0 113.18 168.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.441 ' CG ' HG22 ' A' ' 121' ' ' ILE . 51.2 t80 -71.36 -53.13 15.17 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 130.05 3.34 . . . . 0.0 119.164 -176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.317 0.0 OUTLIER -53.86 -27.65 31.33 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 129.826 3.251 . . . . 0.0 116.271 -172.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 39.9 p -49.58 -41.29 41.45 Favored 'General case' 0 C--N 1.359 0.993 1 C-N-CA 133.627 4.771 . . . . 0.0 113.485 -178.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -142.54 56.5 1.43 Allowed 'General case' 0 C--N 1.36 1.038 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 167.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -98.68 -29.65 12.9 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 125.445 1.498 . . . . 0.0 112.26 176.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 157.23 62.67 0.01 OUTLIER Glycine 0 CA--C 1.487 -1.692 0 N-CA-C 108.171 -1.972 . . . . 0.0 108.171 -166.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.822 HD12 ' H ' ' A' ' 106' ' ' THR . 0.4 OUTLIER -117.46 -73.06 0.66 Allowed 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.363 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.822 ' H ' HD12 ' A' ' 105' ' ' LEU . 6.0 p -128.99 37.0 4.13 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 130.061 3.344 . . . . 0.0 111.016 178.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -89.41 -58.54 1.64 Allowed Glycine 0 C--N 1.361 1.944 0 C-N-CA 125.622 1.582 . . . . 0.0 114.556 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 156.68 -40.02 0.01 OUTLIER 'General case' 0 C--N 1.356 0.864 0 C-N-CA 127.858 2.463 . . . . 0.0 105.206 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.9 t -75.95 163.31 27.31 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.141 2.576 . . . . 0.0 112.68 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . 0.499 ' HG3' ' H ' ' A' ' 111' ' ' ASP . 14.0 tpp -99.83 -160.74 0.82 Allowed 'General case' 0 C--N 1.355 0.841 0 C-N-CA 125.936 1.694 . . . . 0.0 112.267 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.499 ' H ' ' HG3' ' A' ' 110' ' ' MET . 1.2 p30 -88.85 154.23 20.42 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 128.911 2.884 . . . . 0.0 108.154 171.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 14.1 t -20.77 92.63 0.01 OUTLIER 'General case' 0 C--N 1.37 1.499 1 C-N-CA 132.808 4.443 . . . . 0.0 116.748 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.4 t -150.24 -70.3 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.283 0 N-CA-C 103.923 -2.621 . . . . 0.0 103.923 -165.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.4 t -102.13 38.61 1.63 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.36 55.3 p90 -161.13 141.21 10.89 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -125.15 140.84 52.51 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-O 122.897 1.332 . . . . 0.0 110.068 174.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.412 ' HB2' ' HB2' ' A' ' 63' ' ' LEU . 6.2 m-85 -74.23 -13.14 60.74 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 130.179 3.392 . . . . 0.0 111.174 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.57 53.63 Favored 'General case' 0 C--N 1.359 1.003 1 C-N-CA 132.714 4.406 . . . . 0.0 113.588 174.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -135.9 20.03 3.26 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 120.814 -1.179 . . . . 0.0 110.635 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -168.42 -144.65 0.05 Allowed 'General case' 0 C--N 1.369 1.431 0 CA-C-N 120.214 1.37 . . . . 0.0 114.095 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.651 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.467 4.3 pt 76.94 -168.01 0.01 OUTLIER Pre-proline 0 CA--C 1.56 1.353 1 C-N-CA 134.303 5.041 . . . . 0.0 113.706 -176.554 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.651 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 71.7 Cg_endo -70.93 122.61 8.97 Favored 'Trans proline' 0 C--N 1.388 2.631 1 CA-C-N 129.87 4.561 . . . . 0.0 112.403 173.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.7 m -61.04 -20.76 62.93 Favored 'General case' 0 C--N 1.365 1.248 0 C-N-CA 128.226 2.611 . . . . 0.0 115.904 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.401 HG23 HD13 ' A' ' 125' ' ' ILE . 3.3 t -72.85 -41.86 64.34 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.123 2.169 . . . . 0.0 113.6 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.401 HD13 HG23 ' A' ' 124' ' ' THR 0.251 0.5 OUTLIER -70.46 -27.68 32.32 Favored 'Isoleucine or valine' 0 C--N 1.375 1.694 0 C-N-CA 128.098 2.559 . . . . 0.0 111.132 175.593 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.76 -27.26 49.92 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 118.078 -2.889 . . . . 0.0 117.105 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -77.54 -30.87 52.98 Favored 'General case' 0 C--N 1.364 1.218 0 O-C-N 120.206 -1.559 . . . . 0.0 110.659 169.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.6 ttmm -71.12 -14.28 62.24 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 130.714 3.606 . . . . 0.0 113.685 173.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.489 HD23 ' CE2' ' A' ' 91' ' ' PHE . 1.8 tm? -56.76 -29.79 62.97 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 127.699 2.4 . . . . 0.0 112.612 168.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -86.65 -43.19 0.56 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 CA-C-O 113.891 -2.957 . . . . 0.0 118.594 -175.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . 0.259 5.8 Cg_endo -49.27 -6.85 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.966 2 C-N-CA 127.318 5.346 . . . . 0.0 121.094 179.941 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.433 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 11.6 p90 -56.05 -69.45 0.14 Allowed 'General case' 0 C--N 1.372 1.574 0 CA-C-N 122.552 2.433 . . . . 0.0 114.537 174.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.606 ' HG2' ' H ' ' A' ' 134' ' ' LYS . 41.6 ttp180 -158.85 -147.0 0.16 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.686 3.194 . . . . 0.0 106.662 178.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.606 ' H ' ' HG2' ' A' ' 133' ' ' ARG 0.281 7.2 tttt 3.22 0.83 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 2 C-N-CA 139.916 7.287 . . . . 0.0 126.923 177.493 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 23.9 ptp -19.26 18.12 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 2 C-N-CA 138.027 6.531 . . . . 0.0 124.64 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -78.99 67.13 4.61 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 126.875 2.07 . . . . 0.0 114.918 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 . . . . . 0 C--N 1.358 0.937 0 C-N-CA 126.247 1.819 . . . . 0.0 111.7 177.487 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 . . . . . 0 N--CA 1.444 -0.75 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 76.4 mtm180 -84.31 -47.84 10.34 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.537 1.935 . . . . 0.0 113.381 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.7 t -58.76 -34.8 53.04 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 C-N-CA 129.833 3.253 . . . . 0.0 115.362 -176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -68.21 -27.56 66.49 Favored 'General case' 0 C--N 1.367 1.361 0 C-N-CA 126.921 2.088 . . . . 0.0 114.516 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -66.59 -24.49 66.34 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 127.049 2.14 . . . . 0.0 114.441 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.5 mt -66.53 -33.93 76.77 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 128.924 2.889 . . . . 0.0 114.008 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -114.17 -19.89 11.15 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 175.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.1 m -76.02 -17.61 59.6 Favored 'General case' 0 C--N 1.377 1.792 0 C-N-CA 127.129 2.172 . . . . 0.0 113.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -122.31 -72.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.348 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -88.17 72.09 9.15 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 127.228 2.211 . . . . 0.0 112.589 -176.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 167.38 -61.92 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 101.465 -3.532 . . . . 0.0 101.465 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.5 -171.64 0.0 OUTLIER 'General case' 0 C--N 1.384 2.097 0 C-N-CA 126.677 1.991 . . . . 0.0 115.618 169.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -78.18 -26.58 47.68 Favored 'General case' 0 CA--C 1.505 -0.77 0 O-C-N 118.664 -2.523 . . . . 0.0 114.815 -164.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.06 -23.35 63.69 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 130.57 3.548 . . . . 0.0 113.166 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.67 -32.43 67.31 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 129.141 2.976 . . . . 0.0 112.599 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -72.9 -36.39 67.3 Favored 'General case' 0 C--N 1.369 1.42 0 C-N-CA 127.046 2.138 . . . . 0.0 113.25 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -74.62 -42.86 57.84 Favored 'General case' 0 C--N 1.37 1.489 0 C-N-CA 127.309 2.244 . . . . 0.0 110.848 174.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -71.38 -52.34 19.19 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.687 1.995 . . . . 0.0 114.202 177.349 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.521 HG22 HG23 ' A' ' 92' ' ' VAL 0.516 41.4 p -56.66 -34.26 67.16 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 174.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -66.17 -34.35 77.85 Favored 'General case' 0 C--N 1.37 1.462 0 N-CA-C 118.344 2.72 . . . . 0.0 118.344 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 79.8 mtp -51.41 -45.52 62.59 Favored 'General case' 0 C--N 1.38 1.935 0 CA-C-O 127.537 3.542 . . . . 0.0 111.396 172.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 64' ' ' VAL 0.574 0.5 OUTLIER -67.21 -58.44 9.02 Favored Pre-proline 0 C--O 1.206 -1.206 1 CA-C-O 107.656 -5.926 . . . . 0.0 115.385 174.547 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.53 -15.95 3.1 Favored 'Trans proline' 0 C--N 1.381 2.244 2 CA-C-N 138.263 7.558 . . . . 0.0 116.653 168.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.06 -43.06 88.54 Favored 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 122.942 2.61 . . . . 0.0 113.77 159.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.5 tp -70.15 -47.52 61.3 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 166.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 60' ' ' VAL . 18.7 t -68.09 -34.3 65.91 Favored 'Isoleucine or valine' 0 C--N 1.356 0.855 0 O-C-N 117.009 -3.557 . . . . 0.0 112.903 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.399 37.5 tt0 -76.61 -39.65 51.81 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 118.254 -2.778 . . . . 0.0 110.406 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -54.88 42.1 Favored 'General case' 0 C--N 1.389 2.285 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 170.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.446 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.282 . . -72.04 -39.7 68.91 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 130.765 3.626 . . . . 0.0 118.955 178.086 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.5 61.8 Favored 'General case' 0 C--N 1.366 1.305 0 O-C-N 119.42 -2.05 . . . . 0.0 112.89 177.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.16 -23.51 35.36 Favored 'General case' 0 C--N 1.391 2.381 0 C-N-CA 126.934 2.094 . . . . 0.0 114.035 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.275 3.0 tm-20 -55.95 -24.85 40.73 Favored 'General case' 0 C--N 1.359 1.001 1 C-N-CA 133.81 4.844 . . . . 0.0 116.612 172.936 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 39.8 m -106.14 20.16 19.39 Favored 'General case' 0 C--N 1.368 1.407 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -170.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 95.71 -32.92 0.02 OUTLIER 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.95 2.5 . . . . 0.0 116.448 174.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.564 HD22 ' H ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -87.37 131.45 44.11 Favored Pre-proline 0 C--N 1.355 0.823 0 C-N-CA 126.152 1.781 . . . . 0.0 110.839 -179.044 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -90.73 -3.57 4.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.583 2.855 . . . . 0.0 112.058 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.356 2.6 p90 39.24 60.07 1.58 Allowed 'General case' 0 C--N 1.377 1.767 1 C-N-CA 131.832 4.053 . . . . 0.0 116.821 -179.04 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.0 mm -101.25 151.2 5.53 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 C-N-CA 126.445 1.898 . . . . 0.0 109.391 -178.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -99.86 169.5 9.18 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 126.204 1.802 . . . . 0.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -67.35 -11.69 58.3 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 127.307 2.243 . . . . 0.0 116.572 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -100.34 -6.77 25.31 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 127.23 2.212 . . . . 0.0 109.822 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.33 25.36 54.82 Favored Glycine 0 C--N 1.361 1.954 0 C-N-CA 129.028 3.204 . . . . 0.0 115.329 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -86.67 166.26 15.48 Favored 'General case' 0 C--N 1.354 0.794 0 C-N-CA 126.482 1.913 . . . . 0.0 109.347 175.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -85.2 135.27 34.02 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 127.125 2.17 . . . . 0.0 109.372 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 t -116.95 150.25 38.85 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 124.529 1.131 . . . . 0.0 110.931 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.8 122.89 26.34 Favored Pre-proline 0 C--N 1.366 1.313 0 C-N-CA 124.923 1.289 . . . . 0.0 109.316 -176.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -75.21 157.85 41.68 Favored 'Trans proline' 0 CA--C 1.551 1.343 1 C-N-CA 127.406 5.404 . . . . 0.0 114.322 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.05 -50.84 26.61 Favored 'General case' 0 C--N 1.376 1.725 0 N-CA-C 119.189 3.033 . . . . 0.0 119.189 -170.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.77 -45.54 27.4 Favored Glycine 0 N--CA 1.506 3.31 0 O-C-N 118.738 -2.476 . . . . 0.0 113.909 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.42 HG23 ' H ' ' A' ' 88' ' ' VAL . 3.3 t -58.43 -28.63 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.678 0 C-N-CA 128.722 2.809 . . . . 0.0 113.117 176.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.4 OUTLIER -70.03 -44.62 68.9 Favored 'General case' 0 C--N 1.37 1.462 1 C-N-CA 132.288 4.235 . . . . 0.0 112.133 172.332 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.83 -34.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.389 2.32 0 O-C-N 120.882 -1.136 . . . . 0.0 112.202 173.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 43.8 t80 -63.86 -49.68 71.82 Favored 'General case' 0 C--N 1.38 1.916 0 C-N-CA 129.325 3.05 . . . . 0.0 109.947 169.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.521 HG23 HG22 ' A' ' 57' ' ' THR 0.42 10.9 m -50.82 -57.42 2.74 Favored 'Isoleucine or valine' 0 C--N 1.385 2.118 0 CA-C-N 123.389 2.813 . . . . 0.0 114.126 179.458 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.472 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.45 -59.06 4.66 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.567 2.347 . . . . 0.0 116.854 168.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.281 17.7 ptpt -75.03 -30.27 61.03 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -178.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.35 -53.46 52.31 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 129.66 3.184 . . . . 0.0 114.083 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 60' ' ' VAL . . . -77.29 -29.55 53.8 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.493 178.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -62.15 -31.98 72.53 Favored 'General case' 0 C--N 1.37 1.464 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 170.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -69.92 -54.69 12.26 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 127.389 2.276 . . . . 0.0 111.553 173.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -69.95 -38.99 76.3 Favored 'General case' 0 C--N 1.366 1.296 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -177.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.7 ttp -83.6 -27.83 28.92 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 127.892 2.477 . . . . 0.0 114.491 -177.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.2 m -74.21 -51.19 16.19 Favored 'General case' 0 C--N 1.378 1.839 0 O-C-N 120.292 -1.505 . . . . 0.0 109.647 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.423 HD22 ' HA ' ' A' ' 102' ' ' ASN 0.289 2.4 t-20 -174.11 85.22 0.04 OUTLIER 'General case' 0 C--N 1.361 1.075 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 168.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -48.8 -47.38 42.18 Favored 'General case' 0 C--N 1.375 1.704 0 C-N-CA 128.042 2.537 . . . . 0.0 116.566 173.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.23 -46.88 0.05 OUTLIER Glycine 0 CA--C 1.479 -2.212 0 C-N-CA 119.123 -1.513 . . . . 0.0 110.341 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.359 1.3 pt? -118.11 -75.66 0.58 Allowed 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -175.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 p -112.0 17.84 19.3 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 111.585 -168.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 85.14 0.19 Allowed Glycine 0 CA--C 1.54 1.627 0 C-N-CA 130.597 3.951 . . . . 0.0 117.243 -174.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 179.77 -59.56 0.01 OUTLIER 'General case' 0 C--N 1.378 1.83 0 C-N-CA 127.741 2.416 . . . . 0.0 105.252 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.0 m -88.18 168.77 12.47 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.514 2.326 . . . . 0.0 111.626 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 21.7 mmt -90.87 98.55 11.84 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 120.216 -1.553 . . . . 0.0 113.395 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -107.86 24.8 12.39 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.506 1.922 . . . . 0.0 109.87 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.6 t 172.6 -160.26 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.611 1 N-CA-C 99.514 -4.254 . . . . 0.0 99.514 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.264 1.9 p 176.82 -18.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 C-N-CA 126.617 1.967 . . . . 0.0 106.822 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 10.6 t -77.18 58.18 1.54 Allowed 'General case' 0 C--N 1.368 1.37 0 C-N-CA 128.509 2.724 . . . . 0.0 109.797 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -36.96 148.52 0.03 OUTLIER 'General case' 0 C--N 1.365 1.25 2 C-N-CA 135.772 5.629 . . . . 0.0 123.585 -169.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.495 HD22 ' N ' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -94.6 -9.69 34.28 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.677 3.191 . . . . 0.0 116.785 -173.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.495 ' N ' HD22 ' A' ' 116' ' ' ASN . 27.9 m-85 -39.01 -41.48 0.78 Allowed 'General case' 0 C--N 1.372 1.555 0 C-N-CA 130.077 3.351 . . . . 0.0 119.557 -166.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.61 -8.85 59.46 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 130.407 3.483 . . . . 0.0 113.686 177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.2 t -136.43 19.61 3.13 Favored 'General case' 0 C--N 1.355 0.834 0 O-C-N 119.042 -2.286 . . . . 0.0 110.274 175.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 121' ' ' ILE . 7.3 tp10 -148.3 -149.13 0.28 Allowed 'General case' 0 C--N 1.364 1.232 0 CA-C-N 120.056 1.298 . . . . 0.0 113.569 -174.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.576 ' H ' ' HG3' ' A' ' 120' ' ' GLU 0.523 1.5 mm 77.82 -172.05 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.854 0 C-N-CA 131.21 3.804 . . . . 0.0 107.614 -176.449 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.443 ' CD ' HG22 ' A' ' 121' ' ' ILE . 97.9 Cg_endo -82.91 127.53 4.81 Favored 'Trans proline' 0 C--N 1.358 1.027 2 CA-C-N 135.018 6.399 . . . . 0.0 112.211 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -54.82 -29.33 54.52 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 130.283 3.433 . . . . 0.0 118.235 -175.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.279 1.1 t -84.5 -35.16 23.11 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.722 1.209 . . . . 0.0 114.228 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.434 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.39 0.0 OUTLIER -70.88 -27.34 29.96 Favored 'Isoleucine or valine' 0 C--N 1.379 1.881 0 C-N-CA 127.821 2.449 . . . . 0.0 111.107 176.715 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 33.2 tp -52.86 -27.63 19.33 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 129.601 3.16 . . . . 0.0 115.913 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -76.4 -28.04 56.55 Favored 'General case' 0 C--N 1.369 1.443 0 O-C-N 119.963 -1.711 . . . . 0.0 111.595 170.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -75.17 -14.37 60.54 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.189 2.596 . . . . 0.0 112.882 173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.51 ' HB2' ' CD2' ' A' ' 91' ' ' PHE 0.357 0.0 OUTLIER -65.65 -22.78 66.68 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 124.917 1.287 . . . . 0.0 114.144 165.845 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -95.78 -19.49 0.22 Allowed Pre-proline 0 CA--C 1.565 1.532 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -65.22 -8.88 19.91 Favored 'Trans proline' 0 C--N 1.374 1.91 2 CA-C-N 131.67 5.203 . . . . 0.0 117.862 -171.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 135' ' ' MET . 5.9 t80 -83.72 -73.17 0.43 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 130.108 3.363 . . . . 0.0 104.766 170.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.619 0.0 OUTLIER 70.88 -43.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -171.77 -35.52 0.02 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.031 -2.951 . . . . 0.0 103.031 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.421 ' HB2' ' CD1' ' A' ' 132' ' ' TYR . 1.9 ttt 60.1 -48.8 0.09 Allowed 'General case' 0 C--N 1.35 0.63 1 C-N-CA 131.89 4.076 . . . . 0.0 117.019 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -166.47 -44.49 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 125.309 1.443 . . . . 0.0 109.048 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.358 0.967 0 C-N-CA 125.26 1.424 . . . . 0.0 113.096 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 . . . . . 0 N--CA 1.441 -0.904 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -85.11 -18.45 34.21 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.495 2.318 . . . . 0.0 114.232 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.7 p -72.44 -38.82 61.45 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 C-N-CA 128.149 2.579 . . . . 0.0 113.852 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -67.93 -27.61 66.78 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 127.324 2.249 . . . . 0.0 114.969 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.26 79.0 mtt180 -55.24 -24.86 29.98 Favored 'General case' 0 C--N 1.353 0.758 0 C-N-CA 127.578 2.351 . . . . 0.0 116.109 176.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.7 -50.38 11.52 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 127.697 2.399 . . . . 0.0 114.235 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -18.78 29.55 Favored 'General case' 0 C--N 1.354 0.765 0 O-C-N 119.285 -2.134 . . . . 0.0 114.565 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.1 p -68.1 -21.31 64.96 Favored 'General case' 0 C--N 1.372 1.583 0 C-N-CA 126.509 1.924 . . . . 0.0 112.133 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.0 pt -104.78 -48.95 9.51 Favored 'Isoleucine or valine' 0 C--N 1.352 0.68 0 C-N-CA 127.196 2.198 . . . . 0.0 112.924 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.4 m -85.14 -17.1 38.26 Favored 'General case' 0 C--N 1.361 1.09 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -145.85 50.39 1.19 Allowed 'General case' 0 C--N 1.355 0.825 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 -167.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.6 t70 176.14 -71.5 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 104.457 -2.424 . . . . 0.0 104.457 -166.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -88.19 -57.54 2.89 Favored 'General case' 0 C--N 1.375 1.688 0 N-CA-C 120.215 3.413 . . . . 0.0 120.215 -170.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -135.85 36.28 2.85 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.084 -162.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -56.52 -38.17 71.45 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 129.824 3.249 . . . . 0.0 113.113 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 54' ' ' GLU . 1.8 pp20? -73.67 -48.97 28.28 Favored 'General case' 0 N--CA 1.441 -0.908 1 C-N-CA 133.342 4.657 . . . . 0.0 113.593 174.744 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -76.63 -37.92 55.53 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.102 2.161 . . . . 0.0 113.933 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.547 HD13 ' H ' ' A' ' 57' ' ' THR 0.264 0.0 OUTLIER -70.88 -52.86 17.61 Favored 'General case' 0 C--N 1.376 1.739 0 CA-C-N 121.216 1.825 . . . . 0.0 111.467 -177.426 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.547 ' H ' HD13 ' A' ' 56' ' ' LEU 0.608 0.1 OUTLIER -47.5 -30.83 3.75 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 131.116 3.767 . . . . 0.0 118.76 164.793 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -78.95 -40.58 31.51 Favored 'General case' 0 C--N 1.376 1.748 0 CA-C-N 121.674 2.034 . . . . 0.0 115.705 171.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.2 mtp -44.72 -51.6 9.14 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-O 127.888 3.709 . . . . 0.0 113.505 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 96' ' ' ALA 0.404 0.2 OUTLIER -67.58 -54.15 19.31 Favored Pre-proline 0 C--O 1.207 -1.143 1 CA-C-O 110.157 -4.735 . . . . 0.0 113.995 179.649 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.283 32.2 Cg_exo -52.7 -18.91 9.6 Favored 'Trans proline' 0 C--N 1.362 1.245 2 CA-C-N 133.84 5.979 . . . . 0.0 116.925 167.068 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.467 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 7.2 mp -64.11 -42.04 97.02 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 122.57 2.441 . . . . 0.0 112.152 161.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 14.3 tp -71.48 -47.19 57.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 168.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.566 HG12 ' CE2' ' A' ' 91' ' ' PHE 0.437 0.8 OUTLIER -73.23 -36.97 51.07 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.29 0 O-C-N 117.047 -3.533 . . . . 0.0 114.369 179.142 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.364 18.4 tp10 -77.62 -40.85 40.58 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 120.441 1.473 . . . . 0.0 111.585 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.339 0.0 OUTLIER -63.44 -43.36 97.64 Favored 'General case' 0 C--N 1.39 2.362 0 CA-C-N 121.275 1.852 . . . . 0.0 115.239 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -30.53 66.99 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 126.83 2.052 . . . . 0.0 115.127 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD3' ' CE2' ' A' ' 132' ' ' TYR . 14.4 ttpp -75.92 -33.1 59.86 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 129.171 2.988 . . . . 0.0 114.365 175.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -54.01 -21.93 9.36 Favored 'General case' 0 C--N 1.375 1.686 0 C-N-CA 131.401 3.88 . . . . 0.0 114.761 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -56.12 -52.02 65.83 Favored 'General case' 0 N--CA 1.436 -1.137 1 C-N-CA 134.917 5.287 . . . . 0.0 117.4 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.38 12.19 16.27 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -173.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.322 0.0 OUTLIER 70.34 28.83 3.72 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 121.503 3.89 . . . . 0.0 121.503 170.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.461 ' CB ' ' HE ' ' A' ' 133' ' ' ARG 0.272 1.5 p30 -74.64 158.55 84.8 Favored Pre-proline 0 CA--C 1.56 1.338 0 O-C-N 119.65 -1.906 . . . . 0.0 113.203 175.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -82.85 59.42 6.76 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.58 2.853 . . . . 0.0 113.454 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.427 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 6.3 p90 -74.54 45.28 0.23 Allowed 'General case' 0 C--N 1.362 1.118 0 C-N-CA 129.151 2.98 . . . . 0.0 114.782 177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.4 mt -120.85 150.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 C-N-CA 127.976 2.51 . . . . 0.0 108.625 -173.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -115.57 164.79 13.81 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 126.589 1.956 . . . . 0.0 108.207 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -59.9 -1.83 0.33 Allowed 'General case' 0 C--N 1.364 1.239 0 N-CA-C 119.312 3.079 . . . . 0.0 119.312 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -99.08 -15.23 19.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 125.944 1.698 . . . . 0.0 108.69 173.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.14 26.66 33.25 Favored Glycine 0 C--N 1.366 2.242 0 C-N-CA 129.527 3.441 . . . . 0.0 112.42 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.05 165.33 11.57 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 128.237 2.615 . . . . 0.0 106.194 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -76.71 152.86 35.55 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.216 2.206 . . . . 0.0 112.253 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 t -150.18 159.17 44.62 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 121.089 -1.007 . . . . 0.0 108.696 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.9 mp -124.79 139.69 33.94 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.195 2.198 . . . . 0.0 106.983 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -79.8 169.56 17.96 Favored 'Trans proline' 0 C--N 1.37 1.678 0 C-N-CA 124.942 3.761 . . . . 0.0 112.593 171.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -50.4 -41.3 51.95 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.36 -48.81 13.24 Favored Glycine 0 N--CA 1.502 3.038 0 O-C-N 119.612 -1.93 . . . . 0.0 112.255 176.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 132' ' ' TYR 0.257 3.3 t -60.42 -23.52 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.361 0 C-N-CA 127.068 2.147 . . . . 0.0 114.483 172.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' HG22 ' A' ' 92' ' ' VAL . 20.6 tp -70.69 -43.65 68.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 130.087 3.355 . . . . 0.0 113.457 169.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.278 0.3 OUTLIER -62.96 -28.9 45.95 Favored 'Isoleucine or valine' 0 C--N 1.387 2.206 0 CA-C-O 123.152 1.453 . . . . 0.0 112.808 171.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE2' HG12 ' A' ' 64' ' ' VAL . 7.8 t80 -66.92 -49.57 65.13 Favored 'General case' 0 C--N 1.367 1.343 0 C-N-CA 127.087 2.155 . . . . 0.0 110.967 169.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.362 16.1 m -57.81 -52.79 53.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.581 0 CA-C-N 123.814 3.006 . . . . 0.0 116.326 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.78 -49.0 79.42 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 168.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.503 50.7 mttt -75.95 -31.06 58.89 Favored 'General case' 0 C--N 1.379 1.886 0 CA-C-N 122.457 2.39 . . . . 0.0 117.322 -178.59 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.27 -54.3 48.39 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 129.424 3.09 . . . . 0.0 113.672 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.336 . . -78.23 -28.88 47.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 116.705 -1.617 . . . . 0.0 115.094 177.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.588 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.261 6.0 pt20 -67.52 -23.75 65.48 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-N 123.103 2.683 . . . . 0.0 114.204 169.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -73.73 -55.95 5.6 Favored 'General case' 0 C--N 1.367 1.363 0 C-N-CA 125.612 1.565 . . . . 0.0 111.893 166.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 121' ' ' ILE 0.316 0.3 OUTLIER -71.97 -50.63 27.19 Favored 'General case' 0 C--N 1.369 1.448 0 N-CA-C 120.952 3.686 . . . . 0.0 120.952 -177.48 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.422 ' HA ' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -46.5 -38.7 9.64 Favored 'General case' 0 C--N 1.374 1.667 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 -170.731 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.8 m -62.41 -22.16 65.94 Favored 'General case' 0 C--N 1.363 1.164 1 C-N-CA 133.168 4.587 . . . . 0.0 114.276 177.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.76 58.58 0.74 Allowed 'General case' 0 C--N 1.352 0.681 0 N-CA-C 104.846 -2.279 . . . . 0.0 104.846 173.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 100' ' ' MET . . . -92.32 -78.72 0.4 Allowed 'General case' 0 C--N 1.353 0.727 0 O-C-N 121.359 -0.838 . . . . 0.0 111.956 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.14 11.94 6.11 Favored Glycine 0 C--N 1.354 1.578 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.732 HD12 ' H ' ' A' ' 106' ' ' THR . 0.5 OUTLIER -103.1 -55.49 2.4 Favored 'General case' 0 C--N 1.35 0.607 0 C-N-CA 126.132 1.773 . . . . 0.0 108.516 -179.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.732 ' H ' HD12 ' A' ' 105' ' ' LEU . 14.9 t -128.63 31.87 4.91 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.12 -40.73 23.92 Favored Glycine 0 C--N 1.361 1.948 0 C-N-CA 127.707 2.575 . . . . 0.0 114.354 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -168.0 -64.55 0.03 OUTLIER 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 101.032 -3.692 . . . . 0.0 101.032 176.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 m 153.95 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 131.33 3.852 . . . . 0.0 101.03 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . 0.43 ' HB3' HG11 ' A' ' 113' ' ' VAL . 2.0 mpt? -81.97 99.27 9.01 Favored 'General case' 0 C--N 1.362 1.142 0 O-C-N 120.734 -1.229 . . . . 0.0 112.442 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -128.68 119.13 24.08 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.363 63.6 p 80.75 42.44 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 126.36 1.864 . . . . 0.0 113.265 -179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.43 HG11 ' HB3' ' A' ' 110' ' ' MET . 6.9 p -105.83 -18.74 6.89 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 C-N-CA 127.343 2.257 . . . . 0.0 114.676 -175.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.256 76.0 p 101.86 -92.42 0.0 OUTLIER 'General case' 0 C--N 1.371 1.508 1 N-CA-C 99.591 -4.226 . . . . 0.0 99.591 -167.178 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.327 1.5 t80 -165.89 143.25 5.5 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 155.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -60.33 -5.56 1.18 Allowed 'General case' 0 C--N 1.351 0.668 0 N-CA-C 121.057 3.725 . . . . 0.0 121.057 -168.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.481 ' HA ' HG23 ' A' ' 121' ' ' ILE . 3.8 p90 -77.72 -29.59 51.28 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.201 -2.187 . . . . 0.0 113.904 167.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.14 40.32 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 126.49 1.916 . . . . 0.0 113.256 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -112.39 -22.24 10.96 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.133 1.373 . . . . 0.0 113.674 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -135.26 -135.22 0.16 Allowed 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.09 1.768 . . . . 0.0 112.734 -172.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.616 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.37 0.8 OUTLIER 85.86 174.4 0.05 OUTLIER Pre-proline 0 C--N 1.376 1.759 1 C-N-CA 133.046 4.538 . . . . 0.0 111.861 -174.441 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.616 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 24.3 Cg_endo -61.51 119.68 6.94 Favored 'Trans proline' 0 C--N 1.383 2.383 0 CA-C-N 127.944 3.873 . . . . 0.0 114.04 171.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.2 m -62.45 -16.38 54.9 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 127.454 2.301 . . . . 0.0 116.882 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . 0.277 1.3 t -81.82 -43.73 17.9 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 126.926 2.09 . . . . 0.0 112.742 176.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.42 -28.63 35.77 Favored 'Isoleucine or valine' 0 C--N 1.383 2.055 0 CA-C-O 125.785 2.707 . . . . 0.0 111.148 174.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.273 0.5 OUTLIER -55.87 -26.05 45.24 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 129.08 2.952 . . . . 0.0 113.615 172.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -71.8 -29.54 64.56 Favored 'General case' 0 C--N 1.376 1.73 0 O-C-N 119.728 -1.857 . . . . 0.0 112.615 167.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.276 75.9 mttt -70.52 -13.75 62.24 Favored 'General case' 0 C--N 1.376 1.729 0 C-N-CA 129.42 3.088 . . . . 0.0 113.362 170.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -56.31 -36.13 68.33 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 124.937 1.295 . . . . 0.0 113.692 161.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -90.17 -17.99 0.23 Allowed Pre-proline 0 CA--C 1.555 1.153 1 N-CA-C 122.4 4.222 . . . . 0.0 122.4 -174.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -59.51 -6.91 4.72 Favored 'Trans proline' 0 C--N 1.364 1.353 2 CA-C-N 131.973 5.312 . . . . 0.0 121.886 -171.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.56 ' CE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -72.93 -120.77 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 N-CA-C 119.299 3.074 . . . . 0.0 119.299 -176.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.461 ' HE ' ' CB ' ' A' ' 73' ' ' ASN . 5.3 ttp85 -120.05 -2.71 10.19 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 119.964 -1.71 . . . . 0.0 114.414 -174.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.467 ' HB3' ' CE1' ' A' ' 132' ' ' TYR . 0.5 OUTLIER -82.93 -37.45 24.14 Favored 'General case' 0 C--N 1.358 0.966 0 O-C-N 119.125 -2.235 . . . . 0.0 113.656 -177.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 5.6 ttt -36.46 39.93 0.0 OUTLIER 'General case' 0 C--N 1.363 1.171 2 C-N-CA 135.38 5.472 . . . . 0.0 122.159 -177.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -88.34 68.7 8.97 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 119.236 -2.165 . . . . 0.0 111.265 176.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 . . . . . 0 C--N 1.359 0.983 0 C-N-CA 125.708 1.603 . . . . 0.0 111.26 -176.204 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.77 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.312 37.9 mmt180 95.23 -35.38 0.02 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 130.129 3.371 . . . . 0.0 113.748 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -62.61 -45.39 98.93 Favored 'Isoleucine or valine' 0 C--N 1.367 1.327 0 C-N-CA 126.522 1.929 . . . . 0.0 115.554 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.338 0.0 OUTLIER -68.85 -28.74 66.99 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 174.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtt180 -58.75 -25.86 63.42 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 -177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -73.19 -49.56 27.36 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 127.42 2.288 . . . . 0.0 111.332 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 pp -93.27 -17.46 23.6 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 127.659 2.383 . . . . 0.0 115.162 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 t -81.14 2.5 27.21 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 126.264 1.826 . . . . 0.0 109.99 171.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.306 3.5 tt -131.7 -58.32 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.354 0.787 0 C-N-CA 126.326 1.85 . . . . 0.0 112.801 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.3 m -103.74 82.82 2.05 Favored 'General case' 0 C--N 1.363 1.18 0 O-C-N 120.082 -1.636 . . . . 0.0 107.268 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 159.02 -66.43 0.0 OUTLIER 'General case' 0 C--N 1.359 1.01 0 N-CA-C 102.935 -2.987 . . . . 0.0 102.935 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.77 166.17 9.35 Favored 'General case' 0 C--N 1.374 1.674 0 C-N-CA 125.483 1.513 . . . . 0.0 112.525 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -42.07 -29.02 0.21 Allowed 'General case' 0 C--N 1.354 0.78 1 N-CA-C 122.248 4.166 . . . . 0.0 122.248 -169.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -59.85 -22.74 62.7 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 130.05 3.34 . . . . 0.0 113.719 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.18 -31.37 13.53 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 129.552 3.141 . . . . 0.0 113.099 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -71.82 -39.17 70.0 Favored 'General case' 0 C--N 1.373 1.62 0 O-C-N 120.472 -1.393 . . . . 0.0 113.48 170.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -76.74 -40.74 47.51 Favored 'General case' 0 C--N 1.373 1.627 0 O-C-N 120.291 -1.506 . . . . 0.0 112.62 173.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.654 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -60.6 -52.21 66.14 Favored 'General case' 0 C--N 1.378 1.847 0 C-N-CA 126.429 1.891 . . . . 0.0 112.282 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.422 ' N ' HD23 ' A' ' 56' ' ' LEU 0.657 0.0 OUTLIER -55.58 -31.21 62.01 Favored 'General case' 0 C--O 1.212 -0.887 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 164.502 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.44 -41.75 60.31 Favored 'General case' 0 C--N 1.373 1.627 0 CA-C-N 123.548 2.886 . . . . 0.0 115.453 172.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 117' ' ' PHE . 65.2 mmm -54.72 -36.09 64.36 Favored 'General case' 0 C--N 1.382 2.016 0 O-C-N 118.661 -2.525 . . . . 0.0 113.789 174.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.62 ' HB ' HG12 ' A' ' 92' ' ' VAL 0.538 0.2 OUTLIER -73.98 -44.09 6.42 Favored Pre-proline 0 C--O 1.206 -1.191 0 CA-C-O 112.213 -3.756 . . . . 0.0 114.578 -178.115 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 50.3 Cg_exo -51.41 -22.96 13.04 Favored 'Trans proline' 0 C--N 1.361 1.219 2 CA-C-N 130.725 4.866 . . . . 0.0 114.563 159.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 2.8 mp -58.62 -43.05 89.5 Favored 'General case' 0 N--CA 1.511 2.621 0 CA-C-N 122.28 2.309 . . . . 0.0 113.253 159.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.3 tp -75.1 -46.78 32.33 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 118.668 2.84 . . . . 0.0 118.668 170.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 61' ' ' PRO . 98.0 t -64.27 -46.36 93.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 131.603 3.961 . . . . 0.0 112.522 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.325 29.8 mt-10 -76.06 -40.61 52.84 Favored 'General case' 0 C--N 1.368 1.396 0 C-N-CA 124.757 1.223 . . . . 0.0 110.693 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 62' ' ' LEU 0.437 0.0 OUTLIER -63.01 -50.22 71.57 Favored 'General case' 0 C--N 1.396 2.592 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 172.026 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.45 -45.44 65.8 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.491 2.316 . . . . 0.0 114.252 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 133' ' ' ARG 0.648 2.7 mmtm -72.8 -20.41 61.16 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 175.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -54.36 -23.59 16.14 Favored 'General case' 0 C--N 1.387 2.206 0 C-N-CA 125.656 1.583 . . . . 0.0 114.728 170.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -62.19 -35.58 79.3 Favored 'General case' 0 C--N 1.363 1.183 1 C-N-CA 132.504 4.322 . . . . 0.0 115.413 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 73.6 m -111.64 20.71 16.86 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 124.746 1.218 . . . . 0.0 110.415 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.554 11.9 t60 21.16 61.26 0.02 OUTLIER 'General case' 0 C--N 1.37 1.488 1 C-N-CA 133.297 4.639 . . . . 0.0 120.746 -171.629 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.4 HD22 ' HB3' ' A' ' 68' ' ' LYS 0.354 23.0 t30 -77.11 144.33 71.46 Favored Pre-proline 0 N--CA 1.423 -1.786 1 C-N-CA 134.147 4.979 . . . . 0.0 108.599 175.954 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -88.45 61.42 2.95 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.836 3.024 . . . . 0.0 108.376 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -76.77 36.89 0.17 Allowed 'General case' 0 C--N 1.368 1.394 0 C-N-CA 126.535 1.934 . . . . 0.0 113.395 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 65.8 mt -129.64 149.77 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 131.137 3.775 . . . . 0.0 103.034 -176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -114.99 166.77 11.43 Favored 'General case' 0 C--N 1.357 0.905 0 O-C-N 120.365 -1.46 . . . . 0.0 109.243 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.16 -8.06 0.26 Allowed 'General case' 0 C--N 1.367 1.351 0 N-CA-C 120.021 3.341 . . . . 0.0 120.021 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -104.32 -2.73 25.13 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 125.964 1.706 . . . . 0.0 108.901 175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.78 26.1 59.21 Favored Glycine 0 C--N 1.365 2.176 0 C-N-CA 130.263 3.792 . . . . 0.0 115.42 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -107.78 175.46 5.48 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.148 2.179 . . . . 0.0 106.255 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -58.85 153.09 17.85 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.45 151.51 47.64 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.647 -1.283 . . . . 0.0 112.398 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.1 mm -141.16 129.0 12.13 Favored Pre-proline 0 C--N 1.373 1.6 0 C-N-CA 127.031 2.132 . . . . 0.0 108.866 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HG3' ' CG ' ' A' ' 132' ' ' TYR . 17.8 Cg_endo -89.52 -172.51 0.63 Allowed 'Trans proline' 0 CA--C 1.566 2.092 1 C-N-CA 125.566 4.177 . . . . 0.0 110.211 169.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -69.74 -41.42 75.29 Favored 'General case' 0 C--N 1.371 1.519 0 O-C-N 118.35 -2.719 . . . . 0.0 117.915 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.67 -42.53 46.67 Favored Glycine 0 N--CA 1.507 3.403 0 O-C-N 119.26 -2.15 . . . . 0.0 112.79 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.434 ' HA ' ' HB3' ' A' ' 91' ' ' PHE 0.438 3.7 t -66.72 -22.08 29.28 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 125.742 1.617 . . . . 0.0 113.571 168.509 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -66.78 -39.37 87.78 Favored 'General case' 0 C--N 1.378 1.814 0 O-C-N 119.698 -1.877 . . . . 0.0 112.329 169.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.304 0.1 OUTLIER -65.63 -35.79 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 169.263 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 88' ' ' VAL . 64.4 t80 -61.23 -49.96 75.02 Favored 'General case' 0 C--N 1.38 1.904 0 C-N-CA 127.731 2.412 . . . . 0.0 111.233 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.62 HG12 ' HB ' ' A' ' 60' ' ' VAL 0.387 22.1 m -62.02 -60.06 3.33 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.654 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.51 -48.16 63.04 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 168.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.584 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.488 33.7 mtmt -76.1 -28.33 57.48 Favored 'General case' 0 C--N 1.382 1.982 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.05 -57.43 12.61 Favored 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.868 2.467 . . . . 0.0 113.902 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.465 ' HB3' ' HG ' ' A' ' 56' ' ' LEU 0.351 . . -77.14 -28.62 54.29 Favored 'General case' 0 N--CA 1.439 -1.024 0 CA-C-N 113.324 -1.762 . . . . 0.0 114.14 -177.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 94' ' ' LYS . 14.9 pt20 -72.44 -24.6 61.23 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 120.258 -1.526 . . . . 0.0 113.103 165.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -74.03 -57.71 3.78 Favored 'General case' 0 C--N 1.374 1.671 0 CA-C-O 122.639 1.209 . . . . 0.0 112.827 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.271 0.8 OUTLIER -72.9 -53.42 11.4 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.622 2.453 . . . . 0.0 117.622 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -68.64 -27.34 65.92 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.636 2.087 . . . . 0.0 116.636 -171.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -68.69 -5.34 19.78 Favored 'General case' 0 C--N 1.365 1.251 0 C-N-CA 126.858 2.063 . . . . 0.0 114.636 -178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -20.77 66.55 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.762 2.425 . . . . 0.0 112.059 171.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -88.75 13.1 13.19 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 119.966 -1.709 . . . . 0.0 115.149 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -87.46 -9.32 72.64 Favored Glycine 0 C--N 1.361 1.939 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 158.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.394 4.3 pp -118.19 -50.29 2.47 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 117.74 2.496 . . . . 0.0 117.74 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -102.34 32.81 3.37 Favored 'General case' 0 C--N 1.365 1.251 0 CA-C-O 124.032 1.872 . . . . 0.0 106.801 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.35 54.54 0.45 Allowed Glycine 0 CA--C 1.538 1.528 1 C-N-CA 131.837 4.541 . . . . 0.0 117.113 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -103.71 69.79 0.99 Allowed 'General case' 0 C--N 1.366 1.292 0 C-N-CA 128.098 2.559 . . . . 0.0 108.04 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.339 60.2 p 87.41 -112.94 0.01 OUTLIER 'General case' 0 C--N 1.35 0.607 0 C-N-CA 128.151 2.58 . . . . 0.0 110.37 -173.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.3 ptp -139.92 39.65 1.98 Allowed 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -49.69 -52.14 33.29 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 128.22 2.608 . . . . 0.0 116.549 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 2.0 p -118.14 52.85 0.99 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 127.851 2.46 . . . . 0.0 107.76 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.1 t -140.79 -49.74 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -176.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.5 t -90.56 31.63 1.02 Allowed 'General case' 0 C--N 1.369 1.45 0 O-C-N 119.938 -1.726 . . . . 0.0 110.072 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.07 -159.97 0.29 Allowed 'General case' 0 C--N 1.361 1.099 0 C-N-CA 130.26 3.424 . . . . 0.0 115.295 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.68 130.81 13.52 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 119.408 -2.058 . . . . 0.0 115.62 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 59' ' ' MET . 3.1 m-30 -76.44 -4.42 42.4 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 131.238 3.815 . . . . 0.0 116.56 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.08 -8.64 53.48 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.071 1.348 . . . . 0.0 108.85 164.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 42.0 p -118.79 -41.57 2.78 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -150.57 115.42 5.27 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -171.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.08 169.02 11.23 Favored Pre-proline 0 C--N 1.389 2.3 0 C-N-CA 128.663 2.785 . . . . 0.0 106.177 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.612 ' HG2' HD11 ' A' ' 125' ' ' ILE . 79.8 Cg_endo -70.06 159.11 54.35 Favored 'Trans proline' 0 C--N 1.39 2.734 0 CA-C-N 126.354 3.305 . . . . 0.0 115.324 172.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 m -89.24 -21.3 23.3 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 116.196 1.925 . . . . 0.0 116.196 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.8 t -65.24 -44.82 86.93 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 126.321 1.849 . . . . 0.0 115.122 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.612 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.427 2.4 pp -70.98 -26.65 27.95 Favored 'Isoleucine or valine' 0 C--N 1.36 1.053 0 C-N-CA 129.09 2.956 . . . . 0.0 113.397 173.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.314 8.0 tp -54.92 -26.59 37.1 Favored 'General case' 0 C--N 1.366 1.284 0 O-C-N 118.204 -2.81 . . . . 0.0 116.221 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -78.79 -19.38 52.31 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.172 -1.58 . . . . 0.0 112.386 168.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -80.55 -14.92 57.82 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.558 2.343 . . . . 0.0 112.679 172.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.38 -32.73 70.41 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 127.581 2.352 . . . . 0.0 113.52 167.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -81.64 -32.99 0.64 Allowed Pre-proline 0 N--CA 1.441 -0.884 1 N-CA-C 122.99 4.441 . . . . 0.0 122.99 -171.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -61.68 -11.65 21.48 Favored 'Trans proline' 0 C--N 1.373 1.861 1 C-N-CA 126.603 4.869 . . . . 0.0 118.372 -170.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.496 ' CG ' ' HG3' ' A' ' 85' ' ' PRO . 1.0 OUTLIER -93.04 -156.9 0.5 Allowed 'General case' 0 C--N 1.362 1.149 0 C-N-CA 125.116 1.366 . . . . 0.0 108.873 172.17 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.418 ' HA ' ' HE2' ' A' ' 68' ' ' LYS . 25.5 ttt180 166.75 -156.33 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.246 1 N-CA-C 97.901 -4.851 . . . . 0.0 97.901 174.491 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.98 -5.89 56.53 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 127.861 2.464 . . . . 0.0 111.849 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 45.8 mtt 64.65 -43.04 0.3 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.78 3.232 . . . . 0.0 116.168 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 71.55 -54.01 0.68 Allowed 'General case' 0 C--N 1.362 1.14 0 C-N-CA 130.123 3.369 . . . . 0.0 115.383 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 C--N 1.353 0.754 0 C-N-CA 126.46 1.904 . . . . 0.0 109.398 179.046 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 . . . . . 0 N--CA 1.437 -1.105 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 81.66 93.68 0.04 OUTLIER 'General case' 0 C--N 1.364 1.216 0 C-N-CA 127.859 2.464 . . . . 0.0 113.234 177.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.6 m -54.17 -33.82 25.85 Favored 'Isoleucine or valine' 0 C--N 1.37 1.481 0 C-N-CA 129.187 2.995 . . . . 0.0 114.974 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -66.33 -27.34 67.82 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.57 2.748 . . . . 0.0 113.852 173.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.319 41.1 ttp180 -55.74 -24.12 33.32 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.7 mp -78.06 -45.46 23.5 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 128.428 2.691 . . . . 0.0 111.159 170.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -88.58 -18.41 28.13 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 127.53 2.332 . . . . 0.0 116.534 -174.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.8 t -73.92 5.0 4.56 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 129.751 3.22 . . . . 0.0 109.618 168.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.726 HG23 ' H ' ' A' ' 48' ' ' THR . 15.2 tt -148.62 -87.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.176 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.726 ' H ' HG23 ' A' ' 47' ' ' ILE . 13.7 t -81.22 45.14 0.82 Allowed 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.949 2.899 . . . . 0.0 114.492 -167.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -162.28 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.35 0.615 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -173.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -73.12 -82.57 0.05 Allowed 'General case' 0 C--N 1.367 1.332 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 178.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.27 -26.86 22.09 Favored 'General case' 0 C--N 1.366 1.288 1 N-CA-C 122.612 4.301 . . . . 0.0 122.612 -165.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -131.49 25.59 4.78 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.85 -1.156 . . . . 0.0 112.352 -165.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.15 -32.96 74.73 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 126.291 1.837 . . . . 0.0 112.183 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -73.21 -47.4 43.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 131.392 3.877 . . . . 0.0 112.659 174.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -76.53 -39.47 52.8 Favored 'General case' 0 C--N 1.372 1.57 0 O-C-N 120.885 -1.134 . . . . 0.0 112.357 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.367 0.0 OUTLIER -71.67 -51.38 23.33 Favored 'General case' 0 C--N 1.365 1.25 0 O-C-N 120.403 -1.436 . . . . 0.0 113.941 175.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.54 29.5 p -60.37 -34.26 73.62 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 115.05 -2.405 . . . . 0.0 116.436 173.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.289 0.4 OUTLIER -64.94 -36.2 83.62 Favored 'General case' 0 C--N 1.379 1.888 0 N-CA-C 118.592 2.812 . . . . 0.0 118.592 175.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.6 mtm -56.16 -35.51 67.26 Favored 'General case' 0 C--N 1.392 2.448 0 CA-C-O 126.84 3.21 . . . . 0.0 112.465 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.512 0.4 OUTLIER -69.06 -57.26 7.75 Favored Pre-proline 0 N--CA 1.436 -1.155 1 CA-C-O 108.013 -5.756 . . . . 0.0 114.1 174.059 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.419 ' HG3' HD11 ' A' ' 84' ' ' ILE . 49.3 Cg_exo -52.74 -18.22 8.52 Favored 'Trans proline' 0 C--N 1.381 2.253 2 CA-C-N 139.201 7.893 . . . . 0.0 116.461 166.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD22 ' CZ ' ' A' ' 117' ' ' PHE . 5.7 mp -62.41 -39.9 94.8 Favored 'General case' 0 N--CA 1.508 2.453 0 CA-C-N 123.645 2.929 . . . . 0.0 113.31 161.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.05 -50.1 17.58 Favored 'General case' 0 CA--C 1.558 1.262 0 N-CA-C 116.847 2.165 . . . . 0.0 116.847 171.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.332 0.9 OUTLIER -66.5 -38.82 82.52 Favored 'Isoleucine or valine' 0 C--N 1.372 1.564 0 O-C-N 117.278 -3.389 . . . . 0.0 112.642 174.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.503 12.6 tt0 -71.53 -41.94 68.56 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 119.273 -2.142 . . . . 0.0 111.802 177.656 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.287 0.0 OUTLIER -65.05 -50.41 66.3 Favored 'General case' 0 C--N 1.384 2.066 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 171.515 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.04 -39.03 72.53 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 128.19 2.596 . . . . 0.0 115.07 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.344 75.0 tttt -75.41 -21.86 57.89 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 125.46 1.504 . . . . 0.0 113.08 173.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -53.06 -22.93 6.63 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 121.519 1.963 . . . . 0.0 115.903 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.332 13.1 tp10 -63.04 -25.01 68.18 Favored 'General case' 0 N--CA 1.445 -0.689 1 C-N-CA 136.392 5.877 . . . . 0.0 115.14 172.071 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.8 m -95.92 20.19 10.37 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 117.865 2.543 . . . . 0.0 117.865 -166.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.7 m80 94.43 -32.73 0.02 OUTLIER 'General case' 0 C--N 1.364 1.225 0 C-N-CA 127.401 2.28 . . . . 0.0 114.25 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.45 151.77 42.34 Favored Pre-proline 0 C--N 1.346 0.418 0 C-N-CA 126.76 2.024 . . . . 0.0 115.137 -167.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -88.62 -11.13 4.17 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.483 2.788 . . . . 0.0 115.096 177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.427 1.0 OUTLIER 47.91 62.03 2.68 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 129.114 2.966 . . . . 0.0 116.299 -176.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.28 147.19 18.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.871 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.36 167.51 10.8 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 125.573 1.549 . . . . 0.0 108.817 -177.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -58.0 -7.06 0.68 Allowed 'General case' 0 C--N 1.366 1.284 0 N-CA-C 119.338 3.088 . . . . 0.0 119.338 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -107.09 -0.72 22.68 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.049 1.74 . . . . 0.0 108.921 175.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.69 26.73 62.3 Favored Glycine 0 C--N 1.368 2.318 0 C-N-CA 129.78 3.562 . . . . 0.0 115.531 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -106.77 171.45 7.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 128.009 2.524 . . . . 0.0 105.643 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.71 152.57 43.69 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.932 2.093 . . . . 0.0 116.043 -178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.5 t -105.74 108.11 19.45 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 120.465 -1.397 . . . . 0.0 111.958 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.419 HD11 ' HG3' ' A' ' 61' ' ' PRO . 53.4 mt -118.75 85.73 28.4 Favored Pre-proline 0 C--N 1.365 1.271 0 O-C-N 120.095 -1.628 . . . . 0.0 111.345 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.03 167.79 20.74 Favored 'Trans proline' 0 C--N 1.364 1.359 0 C-N-CA 124.325 3.35 . . . . 0.0 113.084 170.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -31.22 5.28 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 130.248 3.419 . . . . 0.0 120.028 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.58 -44.12 21.95 Favored Glycine 0 N--CA 1.493 2.497 0 C-N-CA 124.628 1.109 . . . . 0.0 113.668 171.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.397 0.0 OUTLIER -71.15 -22.91 22.86 Favored 'Isoleucine or valine' 0 C--N 1.372 1.544 0 O-C-N 119.197 -2.355 . . . . 0.0 113.018 175.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 1.0 OUTLIER -70.19 -44.42 68.73 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 129.593 3.157 . . . . 0.0 112.707 174.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.409 8.4 tt -65.14 -27.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.375 1.705 0 C-N-CA 124.483 1.113 . . . . 0.0 112.638 171.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -67.51 -58.5 4.62 Favored 'General case' 0 C--N 1.377 1.794 0 CA-C-O 116.787 -1.577 . . . . 0.0 112.847 164.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.382 11.1 m -51.18 -61.33 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.932 0 CA-C-N 121.886 2.13 . . . . 0.0 116.322 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -51.78 -57.38 9.45 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 128.992 2.917 . . . . 0.0 115.463 170.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -75.59 -27.79 58.67 Favored 'General case' 0 C--N 1.374 1.652 0 CA-C-N 124.766 3.439 . . . . 0.0 114.835 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.23 -57.21 13.78 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.272 1.829 . . . . 0.0 115.339 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.26 . . -78.8 -29.07 44.67 Favored 'General case' 0 C--N 1.371 1.506 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 179.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.44 ' CD ' HG21 ' A' ' 48' ' ' THR . 7.5 tt0 -58.54 -35.07 71.74 Favored 'General case' 0 C--N 1.375 1.712 0 C-N-CA 126.161 1.785 . . . . 0.0 114.264 172.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.475 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 2.3 t80 -73.68 -56.68 4.69 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 124.216 1.006 . . . . 0.0 112.457 171.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -72.31 -46.71 54.5 Favored 'General case' 0 C--N 1.371 1.528 1 N-CA-C 124.546 5.017 . . . . 0.0 124.546 -175.825 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.456 8.1 ptm -69.09 -26.81 65.12 Favored 'General case' 0 C--N 1.366 1.32 0 O-C-N 119.107 -2.246 . . . . 0.0 113.093 -177.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.9 m -54.95 -34.66 63.45 Favored 'General case' 0 C--N 1.366 1.32 1 C-N-CA 133.125 4.57 . . . . 0.0 113.47 170.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -94.91 -48.62 5.93 Favored 'General case' 0 C--N 1.368 1.405 0 C-N-CA 126.963 2.105 . . . . 0.0 112.24 172.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.437 ' HB1' ' HA3' ' A' ' 107' ' ' GLY 0.387 . . -49.69 37.68 0.0 OUTLIER 'General case' 0 C--N 1.366 1.3 1 N-CA-C 123.092 4.478 . . . . 0.0 123.092 -174.666 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -95.67 11.75 68.06 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 118.531 -2.606 . . . . 0.0 110.797 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.503 ' HG ' ' N ' ' A' ' 106' ' ' THR . 2.6 pt? -117.86 -65.52 1.17 Allowed 'General case' 0 CA--C 1.501 -0.908 0 C-N-CA 127.81 2.444 . . . . 0.0 112.932 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.503 ' N ' ' HG ' ' A' ' 105' ' ' LEU . 13.1 t -82.51 -37.65 24.95 Favored 'General case' 0 CA--C 1.495 -1.145 0 C-N-CA 129.45 3.1 . . . . 0.0 107.806 -175.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.437 ' HA3' ' HB1' ' A' ' 103' ' ' ALA . . . -76.73 32.61 1.44 Allowed Glycine 0 C--N 1.362 2.022 0 N-CA-C 117.818 1.887 . . . . 0.0 117.818 175.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -148.22 138.1 22.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 120.169 -1.783 . . . . 0.0 109.456 -169.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.355 60.4 p 88.23 -12.74 0.44 Allowed 'General case' 0 C--N 1.362 1.142 0 N-CA-C 117.469 2.396 . . . . 0.0 117.469 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 39.8 mtt 77.78 58.09 0.03 OUTLIER 'General case' 0 C--N 1.358 0.968 0 C-N-CA 127.15 2.18 . . . . 0.0 113.594 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -89.77 65.94 6.93 Favored 'General case' 0 C--N 1.361 1.084 0 C-N-CA 126.366 1.866 . . . . 0.0 110.775 178.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.2 m 135.4 -63.73 0.0 OUTLIER 'General case' 0 C--N 1.358 0.956 0 C-N-CA 130.654 3.582 . . . . 0.0 105.121 -178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.418 0.4 OUTLIER 113.06 -21.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.366 1.302 0 C-N-CA 130.548 3.539 . . . . 0.0 110.916 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.423 ' HA ' ' CE2' ' A' ' 117' ' ' PHE . 66.8 m -116.39 36.15 4.23 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.036 1.735 . . . . 0.0 110.697 179.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -52.64 14.22 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 1 C-N-CA 133.225 4.61 . . . . 0.0 119.9 -175.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 120' ' ' GLU . 1.7 m-80 -153.04 -44.27 0.1 Allowed 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 126.625 1.97 . . . . 0.0 108.189 -170.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.453 ' CZ ' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -78.96 -55.21 5.31 Favored 'General case' 0 C--N 1.347 0.469 0 O-C-N 119.09 -2.256 . . . . 0.0 113.972 178.271 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.67 -41.58 11.85 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 126.445 1.898 . . . . 0.0 114.47 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.265 1.8 p -83.79 -22.17 31.92 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 120.04 1.291 . . . . 0.0 111.156 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 116' ' ' ASN 0.422 28.0 mm-40 86.5 158.05 0.08 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.971 2.508 . . . . 0.0 117.56 174.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.644 HD13 ' H ' ' A' ' 121' ' ' ILE . 0.1 OUTLIER -99.54 -151.79 0.01 OUTLIER Pre-proline 0 C--N 1.369 1.448 0 C-N-CA 130.718 3.607 . . . . 0.0 108.51 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.632 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 72.1 Cg_endo -70.55 135.11 27.8 Favored 'Trans proline' 0 C--N 1.38 2.193 1 CA-C-N 130.789 4.889 . . . . 0.0 113.412 173.119 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -59.81 -19.05 48.33 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 128.113 2.565 . . . . 0.0 116.538 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -73.99 -44.61 54.08 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 127.652 2.381 . . . . 0.0 112.953 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.372 1.8 mm -71.28 -27.96 30.83 Favored 'Isoleucine or valine' 0 C--N 1.375 1.693 0 C-N-CA 127.431 2.292 . . . . 0.0 112.344 174.49 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.265 13.3 tp -58.76 -26.27 63.85 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.577 2.751 . . . . 0.0 114.836 175.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -72.14 -35.26 69.03 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 127.267 2.227 . . . . 0.0 110.683 168.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.325 3.7 mptp? -68.45 -13.32 62.22 Favored 'General case' 0 C--N 1.373 1.606 0 C-N-CA 129.57 3.148 . . . . 0.0 112.335 170.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.26 -32.42 66.58 Favored 'General case' 0 N--CA 1.515 2.815 0 CA-C-N 121.559 1.981 . . . . 0.0 113.89 164.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -95.46 -3.45 0.1 Allowed Pre-proline 0 CA--C 1.559 1.325 1 N-CA-C 124.199 4.888 . . . . 0.0 124.199 -175.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -74.59 -8.13 20.2 Favored 'Trans proline' 0 CA--C 1.547 1.155 2 CA-C-N 130.946 4.945 . . . . 0.0 114.799 175.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -146.69 0.0 OUTLIER 'General case' 0 C--N 1.365 1.245 2 C-N-CA 134.387 5.075 . . . . 0.0 122.654 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -102.25 112.54 25.27 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 126.406 1.883 . . . . 0.0 106.688 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.257 11.8 tmtt? 136.06 -66.56 0.0 OUTLIER 'General case' 0 C--N 1.363 1.194 0 C-N-CA 128.208 2.603 . . . . 0.0 105.329 -178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 64.6 mtt 71.86 -43.89 0.58 Allowed 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.072 2.949 . . . . 0.0 114.949 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . 0.275 . . 97.99 -133.39 0.0 OUTLIER 'General case' 0 C--N 1.358 0.937 0 C-N-CA 130.732 3.613 . . . . 0.0 111.797 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 . . . . . 0 C--N 1.353 0.727 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -178.341 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 . . . . . 0 N--CA 1.44 -0.971 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -120.69 142.25 49.66 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.414 1.886 . . . . 0.0 107.608 -179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.07 -34.1 61.7 Favored 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 130.306 3.443 . . . . 0.0 113.558 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -67.94 -27.87 66.99 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 128.362 2.665 . . . . 0.0 114.291 174.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . 0.441 24.1 mmm180 -65.74 -23.31 66.71 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 116.368 1.988 . . . . 0.0 116.368 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.13 -49.72 66.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.318 2.647 . . . . 0.0 112.881 171.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.67 -18.1 22.51 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 127.965 2.506 . . . . 0.0 115.162 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 m -68.92 -23.59 64.19 Favored 'General case' 0 C--N 1.38 1.926 0 C-N-CA 126.684 1.993 . . . . 0.0 111.31 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.459 HG23 ' HB2' ' A' ' 52' ' ' HIS . 24.3 mt -105.29 -82.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 128.072 2.549 . . . . 0.0 109.324 178.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.21 67.17 9.66 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 127.439 2.296 . . . . 0.0 113.396 -172.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 171.32 -68.23 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.26 -119.64 0.0 OUTLIER 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.27 -10.83 48.33 Favored 'General case' 0 C--N 1.367 1.337 0 N-CA-C 120.378 3.473 . . . . 0.0 120.378 -167.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.459 ' HB2' HG23 ' A' ' 47' ' ' ILE . 87.7 m-70 -130.02 26.92 5.18 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.744 -1.222 . . . . 0.0 111.47 -165.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.14 -39.87 78.58 Favored 'General case' 0 C--N 1.371 1.531 0 C-N-CA 126.882 2.073 . . . . 0.0 112.612 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -73.34 -38.98 65.56 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 129.724 3.21 . . . . 0.0 114.236 173.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -76.17 -32.06 58.84 Favored 'General case' 0 C--N 1.372 1.554 0 C-N-CA 123.944 0.898 . . . . 0.0 112.622 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.492 0.0 OUTLIER -65.64 -49.84 67.19 Favored 'General case' 0 C--N 1.363 1.194 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 178.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.465 16.7 p -62.17 -38.47 89.19 Favored 'General case' 0 C--N 1.359 0.982 0 CA-C-N 125.586 3.812 . . . . 0.0 116.325 172.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -49.59 -46.07 48.64 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 6.7 ptm -52.6 -35.83 55.01 Favored 'General case' 0 C--N 1.38 1.899 0 C-N-CA 128.377 2.671 . . . . 0.0 112.915 171.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.516 2.4 t -73.74 -57.14 2.62 Favored Pre-proline 0 C--N 1.356 0.874 1 CA-C-O 108.969 -5.301 . . . . 0.0 115.087 172.488 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.69 -17.2 4.62 Favored 'Trans proline' 0 C--N 1.382 2.301 3 CA-C-N 138.486 7.638 . . . . 0.0 116.638 168.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.81 -48.19 72.57 Favored 'General case' 0 C--N 1.376 1.745 0 CA-C-N 121.237 1.835 . . . . 0.0 112.569 160.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.447 HD23 HG13 ' A' ' 60' ' ' VAL . 32.9 tp -70.27 -55.64 8.75 Favored 'General case' 0 C--N 1.368 1.378 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.314 4.0 p -74.65 -30.81 25.63 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 O-C-N 117.312 -3.367 . . . . 0.0 116.098 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.633 3.3 mm-40 -79.01 -30.28 44.15 Favored 'General case' 0 C--N 1.376 1.758 0 CA-C-N 120.037 1.29 . . . . 0.0 110.873 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -46.97 64.17 Favored 'General case' 0 C--N 1.401 2.841 0 C-N-CA 126.437 1.895 . . . . 0.0 111.626 163.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.62 -58.03 4.44 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 128.153 2.581 . . . . 0.0 114.845 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.45 ' HG2' ' HB2' ' A' ' 132' ' ' TYR 0.502 1.3 tmtp? -53.4 -22.56 7.81 Favored 'General case' 0 C--N 1.371 1.511 0 C-N-CA 128.016 2.526 . . . . 0.0 116.555 179.117 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.92 -23.99 67.64 Favored 'General case' 0 C--N 1.364 1.2 0 C-N-CA 126.302 1.841 . . . . 0.0 113.85 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.65 -35.98 60.28 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 129.902 3.281 . . . . 0.0 116.98 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.22 21.06 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 N-CA-C 120.148 3.388 . . . . 0.0 120.148 -167.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.252 1.5 t-80 96.39 -21.38 0.05 OUTLIER 'General case' 0 C--N 1.351 0.67 0 C-N-CA 127.219 2.207 . . . . 0.0 112.888 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.422 HD21 ' HE2' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -138.13 139.06 24.54 Favored Pre-proline 0 C--N 1.358 0.935 0 CA-C-O 116.929 -1.51 . . . . 0.0 107.949 -177.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -85.63 49.92 2.51 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 CA-C-N 124.39 2.603 . . . . 0.0 111.309 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.25 8.3 p90 40.33 7.65 0.0 OUTLIER 'General case' 0 C--N 1.382 1.984 1 C-N-CA 132.58 4.352 . . . . 0.0 119.976 177.858 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -91.22 140.95 15.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.536 0 C-N-CA 128.449 2.7 . . . . 0.0 112.675 -172.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -115.62 -162.74 0.85 Allowed 'General case' 0 C--N 1.365 1.244 0 C-N-CA 126.181 1.792 . . . . 0.0 113.388 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.1 tptt -62.78 -24.8 67.91 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 129.262 3.025 . . . . 0.0 118.421 -176.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -109.29 9.7 25.76 Favored 'General case' 0 C--N 1.363 1.159 0 O-C-N 119.523 -1.986 . . . . 0.0 109.242 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 69.87 30.1 70.52 Favored Glycine 0 C--N 1.365 2.168 0 C-N-CA 130.27 3.795 . . . . 0.0 115.975 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -92.77 158.46 15.89 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 128.29 2.636 . . . . 0.0 109.701 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.11 153.6 25.98 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 128.105 2.562 . . . . 0.0 109.838 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.8 t -128.84 128.63 44.28 Favored 'General case' 0 C--N 1.354 0.79 0 O-C-N 120.162 -1.586 . . . . 0.0 109.378 -172.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.9 mt -117.89 119.32 33.89 Favored Pre-proline 0 C--N 1.369 1.452 0 C-N-CA 126.481 1.912 . . . . 0.0 107.482 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.466 ' HG2' ' HB ' ' A' ' 88' ' ' VAL . 90.1 Cg_endo -81.29 -177.44 3.67 Favored 'Trans proline' 0 CA--C 1.555 1.526 1 C-N-CA 126.058 4.506 . . . . 0.0 112.804 176.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 t -67.47 -48.24 67.74 Favored 'General case' 0 C--N 1.369 1.424 0 C-N-CA 127.544 2.337 . . . . 0.0 116.486 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.442 ' O ' HD13 ' A' ' 90' ' ' ILE . . . -70.94 -33.91 65.57 Favored Glycine 0 N--CA 1.503 3.129 0 O-C-N 119.789 -1.819 . . . . 0.0 114.008 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 85' ' ' PRO 0.592 1.5 t -73.47 -22.66 19.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.99 0 O-C-N 120.003 -1.881 . . . . 0.0 114.616 171.69 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.465 ' HA ' HG22 ' A' ' 92' ' ' VAL . 4.6 tt -66.93 -44.23 81.2 Favored 'General case' 0 C--N 1.375 1.691 0 C-N-CA 126.603 1.961 . . . . 0.0 111.632 169.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.442 HD13 ' O ' ' A' ' 87' ' ' GLY 0.567 0.1 OUTLIER -66.35 -28.92 44.98 Favored 'Isoleucine or valine' 0 C--N 1.382 1.987 0 O-C-N 120.392 -1.442 . . . . 0.0 114.186 172.823 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -63.95 -50.89 66.85 Favored 'General case' 0 C--N 1.38 1.93 0 C-N-CA 125.417 1.487 . . . . 0.0 112.158 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.487 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.372 26.2 m -53.83 -61.47 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.911 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 178.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -51.99 -54.68 26.96 Favored 'General case' 0 C--N 1.365 1.249 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.422 2.2 ptpt -74.59 -36.5 63.0 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.74 88.6 Favored 'General case' 0 C--N 1.374 1.673 0 O-C-N 119.619 -1.926 . . . . 0.0 114.016 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.61 -39.22 84.74 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 112.395 -2.184 . . . . 0.0 115.975 175.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.304 0.4 OUTLIER -67.47 -23.53 65.51 Favored 'General case' 0 C--N 1.371 1.536 0 O-C-N 119.797 -1.814 . . . . 0.0 114.229 173.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -73.66 -56.43 5.01 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-N 120.89 1.677 . . . . 0.0 114.458 168.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.328 6.5 t80 -72.66 -33.86 66.84 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 119.813 3.264 . . . . 0.0 119.813 -174.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.263 0.0 OUTLIER -72.75 -37.26 67.74 Favored 'General case' 0 C--N 1.369 1.454 0 O-C-N 120.187 -1.571 . . . . 0.0 113.82 -175.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 t -65.84 -7.88 18.77 Favored 'General case' 0 C--N 1.365 1.257 0 C-N-CA 126.411 1.884 . . . . 0.0 115.431 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -123.7 -55.3 1.72 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.155 1.782 . . . . 0.0 109.497 172.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.96 11.68 22.05 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 117.721 2.489 . . . . 0.0 117.721 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.35 -11.09 72.81 Favored Glycine 0 C--N 1.355 1.6 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 155.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.438 4.5 pp -118.8 -50.52 2.4 Favored 'General case' 0 C--N 1.368 1.392 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.8 t -114.58 37.62 3.35 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.752 2.021 . . . . 0.0 105.758 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.79 -43.56 27.9 Favored Glycine 0 C--N 1.359 1.822 0 C-N-CA 127.313 2.387 . . . . 0.0 116.184 -169.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.324 77.5 mtp180 89.9 39.66 0.01 OUTLIER 'General case' 0 C--N 1.364 1.238 0 C-N-CA 127.104 2.161 . . . . 0.0 112.779 169.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.2 t -175.56 172.09 2.67 Favored 'General case' 0 N--CA 1.442 -0.871 1 N-CA-C 98.883 -4.488 . . . . 0.0 98.883 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 36.6 ttm -92.37 -115.78 0.09 Allowed 'General case' 0 C--N 1.362 1.117 0 CA-C-N 119.978 1.263 . . . . 0.0 113.151 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -90.06 -71.2 0.63 Allowed 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.614 1.565 . . . . 0.0 112.07 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.291 10.3 t -148.4 80.23 1.45 Allowed 'General case' 0 C--N 1.349 0.571 0 N-CA-C 104.253 -2.499 . . . . 0.0 104.253 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.7 t -113.99 -86.01 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.6 t -115.83 82.62 1.8 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.432 ' CD2' ' CE2' ' A' ' 117' ' ' PHE . 0.4 OUTLIER -93.12 154.79 17.88 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 119.726 3.232 . . . . 0.0 119.726 -171.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -94.49 -4.61 47.82 Favored 'General case' 0 C--N 1.354 0.791 0 C-N-CA 130.78 3.632 . . . . 0.0 116.404 -173.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 115' ' ' TYR . 29.1 m-85 -63.74 -14.5 53.08 Favored 'General case' 0 C--N 1.377 1.768 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -172.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.2 -18.79 27.92 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.26 2.224 . . . . 0.0 113.366 173.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.0 t -136.68 -2.76 2.13 Favored 'General case' 0 C--N 1.363 1.157 0 N-CA-C 118.711 2.856 . . . . 0.0 118.711 -174.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -109.22 -109.89 0.33 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 124.218 3.19 . . . . 0.0 112.062 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . 0.363 0.0 OUTLIER 55.02 176.27 0.04 OUTLIER Pre-proline 0 C--N 1.38 1.924 0 C-N-CA 129.688 3.195 . . . . 0.0 117.286 174.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.43 116.26 3.96 Favored 'Trans proline' 0 C--N 1.376 2.014 0 CA-C-N 125.442 2.979 . . . . 0.0 112.289 168.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.1 t -69.57 -1.01 7.63 Favored 'General case' 0 C--N 1.367 1.341 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -175.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 86.3 m -85.45 -42.71 14.24 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 128.559 2.744 . . . . 0.0 111.234 172.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.501 0.0 OUTLIER -70.22 -26.16 28.85 Favored 'Isoleucine or valine' 0 C--N 1.371 1.534 0 C-N-CA 127.747 2.419 . . . . 0.0 112.54 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.4 mt -50.51 -25.3 3.89 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 129.512 3.125 . . . . 0.0 115.637 166.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -75.13 -33.25 61.54 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.864 2.066 . . . . 0.0 112.008 169.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -80.57 -13.83 58.73 Favored 'General case' 0 C--N 1.37 1.461 0 C-N-CA 131.407 3.883 . . . . 0.0 112.069 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.34 -43.55 83.51 Favored 'General case' 0 C--N 1.372 1.569 0 C-N-CA 127.331 2.252 . . . . 0.0 112.59 165.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.303 70.5 m-80 -58.03 -35.8 37.8 Favored Pre-proline 0 C--N 1.361 1.077 0 C-N-CA 130.851 3.66 . . . . 0.0 117.29 -178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -48.95 -6.89 0.06 OUTLIER 'Trans proline' 0 CA--C 1.554 1.499 1 C-N-CA 127.525 5.483 . . . . 0.0 117.999 157.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.45 ' HB2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.11 57.45 0.0 OUTLIER 'General case' 0 C--N 1.377 1.789 0 C-N-CA 131.063 3.745 . . . . 0.0 119.592 175.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.415 ' HB2' ' HG3' ' A' ' 85' ' ' PRO . 6.2 tmm_? 62.33 -78.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 129.389 3.076 . . . . 0.0 117.208 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -77.42 51.68 0.89 Allowed 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.311 2.644 . . . . 0.0 114.781 -172.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 11.2 tpt -65.52 51.89 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 130.549 3.54 . . . . 0.0 116.144 -177.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -107.02 -4.29 19.15 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 119.652 -1.905 . . . . 0.0 110.989 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 . . . . . 0 C--N 1.356 0.865 0 C-N-CA 125.551 1.54 . . . . 0.0 107.454 -177.492 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -117.87 127.88 54.29 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 103.972 -2.603 . . . . 0.0 103.972 176.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 12.3 t -55.66 -43.76 74.41 Favored 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.121 2.568 . . . . 0.0 116.011 -174.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.262 14.7 ptmm? -68.05 -28.02 67.02 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 126.266 1.826 . . . . 0.0 114.218 174.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.0 ttp180 -59.58 -27.06 65.93 Favored 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.404 1.882 . . . . 0.0 114.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.6 mt -70.67 -40.22 73.09 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 128.877 2.871 . . . . 0.0 114.191 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.12 -18.71 15.43 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.451 1.5 . . . . 0.0 114.726 174.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.4 m -76.07 -16.38 59.94 Favored 'General case' 0 C--N 1.383 2.025 0 C-N-CA 126.844 2.058 . . . . 0.0 113.441 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mt -122.97 -69.69 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.667 0 C-N-CA 127.72 2.408 . . . . 0.0 111.54 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.0 m -92.62 81.48 4.78 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 120.384 1.447 . . . . 0.0 109.079 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 159.0 -61.43 0.0 OUTLIER 'General case' 0 C--N 1.352 0.716 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -178.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.98 -141.72 0.0 OUTLIER 'General case' 0 C--N 1.381 1.939 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 172.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -87.25 -21.73 25.64 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 117.911 -2.993 . . . . 0.0 118.467 -167.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -83.62 -7.82 59.43 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 125.865 1.666 . . . . 0.0 112.543 -173.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -54.66 -44.52 73.34 Favored 'General case' 0 C--N 1.373 1.611 0 C-N-CA 130.176 3.39 . . . . 0.0 113.155 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.58 -32.79 66.29 Favored 'General case' 0 C--N 1.356 0.872 0 C-N-CA 127.415 2.286 . . . . 0.0 113.599 172.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -76.59 -49.67 15.75 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.255 1.422 . . . . 0.0 114.272 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.477 0.0 OUTLIER -71.96 -45.7 60.11 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 126.589 1.956 . . . . 0.0 113.456 178.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.588 HG22 HG23 ' A' ' 92' ' ' VAL 0.533 40.8 p -55.53 -34.04 64.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 119.878 3.288 . . . . 0.0 119.878 173.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 61' ' ' PRO . 63.3 mm-40 -64.95 -34.45 78.44 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 129.459 3.103 . . . . 0.0 117.347 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.274 13.3 tpt -45.01 -41.77 7.73 Favored 'General case' 0 C--N 1.387 2.229 2 C-N-CA 133.151 4.58 . . . . 0.0 109.938 168.196 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG21 ' HA ' ' A' ' 92' ' ' VAL 0.559 2.8 t -76.52 -61.61 0.75 Allowed Pre-proline 0 C--O 1.21 -1.0 1 CA-C-O 107.796 -5.859 . . . . 0.0 114.575 172.567 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 58' ' ' GLU 0.36 23.5 Cg_exo -51.61 -22.69 13.39 Favored 'Trans proline' 0 C--N 1.367 1.507 2 CA-C-N 139.412 7.969 . . . . 0.0 120.111 176.054 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' CE2' ' A' ' 117' ' ' PHE 0.398 6.0 mt -73.4 -39.24 65.22 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 125.385 3.721 . . . . 0.0 112.272 163.135 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 121' ' ' ILE . 15.4 tp -63.43 -52.36 61.84 Favored 'General case' 0 C--N 1.378 1.823 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 171.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 129' ' ' LEU 0.283 12.3 p -73.17 -42.7 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.534 0 C-N-CA 128.364 2.665 . . . . 0.0 113.07 177.301 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.472 3.3 mm-40 -72.6 -36.25 68.07 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 121.527 1.967 . . . . 0.0 111.945 -176.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.298 0.0 OUTLIER -64.7 -50.69 65.96 Favored 'General case' 0 C--N 1.388 2.27 0 O-C-N 120.544 -1.348 . . . . 0.0 114.098 171.269 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.28 -38.79 75.13 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.101 2.16 . . . . 0.0 113.826 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.253 47.5 tttp -70.95 -21.75 62.29 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.207 2.203 . . . . 0.0 114.793 175.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -52.24 -23.25 5.36 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 127.204 2.202 . . . . 0.0 115.373 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.282 4.8 tm-20 -64.82 -18.62 65.28 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 135.544 5.538 . . . . 0.0 117.468 172.173 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 12.2 m -105.49 20.28 19.16 Favored 'General case' 0 C--N 1.375 1.694 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -166.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.251 75.2 m80 100.0 -41.93 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 128.639 2.776 . . . . 0.0 113.262 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.01 153.88 41.79 Favored Pre-proline 0 C--N 1.354 0.789 0 N-CA-C 115.941 1.83 . . . . 0.0 115.941 -170.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -88.3 -9.14 5.24 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.431 2.754 . . . . 0.0 112.949 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.389 2.2 p90 43.96 40.21 3.17 Favored 'General case' 0 C--N 1.384 2.102 0 C-N-CA 129.887 3.275 . . . . 0.0 116.957 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 94.1 mt -135.1 140.6 44.86 Favored 'Isoleucine or valine' 0 C--N 1.359 0.983 0 N-CA-C 102.048 -3.316 . . . . 0.0 102.048 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -115.91 177.73 4.57 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 124.326 1.051 . . . . 0.0 111.977 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -50.52 -19.03 0.77 Allowed 'General case' 0 C--N 1.361 1.099 0 N-CA-C 120.61 3.559 . . . . 0.0 120.61 -178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -102.3 -5.74 23.9 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.468 1.507 . . . . 0.0 109.528 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.27 29.79 52.28 Favored Glycine 0 C--N 1.364 2.134 0 C-N-CA 129.583 3.468 . . . . 0.0 114.21 -176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -94.09 153.09 18.31 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 128.141 2.576 . . . . 0.0 105.765 176.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -86.67 150.91 23.85 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 129.029 2.932 . . . . 0.0 114.478 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.8 t -94.26 97.74 10.45 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.52 -1.988 . . . . 0.0 112.182 -175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 mm -104.79 99.66 19.79 Favored Pre-proline 0 C--N 1.36 1.046 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -77.87 177.43 8.81 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 124.223 3.282 . . . . 0.0 111.287 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.3 m -55.74 -44.79 77.91 Favored 'General case' 0 C--N 1.363 1.161 0 N-CA-C 118.862 2.912 . . . . 0.0 118.862 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.08 -43.7 56.18 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.834 -1.166 . . . . 0.0 113.559 176.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 92' ' ' VAL 0.419 1.1 t -65.14 -28.62 45.09 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 O-C-N 120.805 -1.409 . . . . 0.0 113.482 174.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.84 -43.64 75.08 Favored 'General case' 0 C--N 1.382 2.02 0 C-N-CA 127.601 2.36 . . . . 0.0 113.144 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 7.6 pt -62.58 -35.42 70.14 Favored 'Isoleucine or valine' 0 C--N 1.389 2.311 0 CA-C-N 119.936 1.243 . . . . 0.0 112.458 176.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 125' ' ' ILE . 25.0 t80 -61.95 -55.19 31.96 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 129.048 2.939 . . . . 0.0 110.457 170.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 88' ' ' VAL 0.438 1.3 m -51.63 -56.54 5.34 Favored 'Isoleucine or valine' 0 C--N 1.379 1.883 0 CA-C-N 122.029 2.195 . . . . 0.0 116.403 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.99 -57.06 9.55 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 130.658 3.583 . . . . 0.0 115.657 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -75.84 -28.95 58.44 Favored 'General case' 0 C--N 1.372 1.554 0 CA-C-N 122.264 2.302 . . . . 0.0 116.54 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.73 -57.02 14.46 Favored 'General case' 0 CA--C 1.487 -1.462 0 C-N-CA 128.24 2.616 . . . . 0.0 115.103 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.345 . . -80.45 -31.09 37.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 112.587 -2.097 . . . . 0.0 113.272 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -64.63 -32.11 73.63 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-N 120.192 1.36 . . . . 0.0 113.451 172.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -54.55 8.13 Favored 'General case' 0 C--N 1.35 0.617 0 C-N-CA 126.632 1.973 . . . . 0.0 111.765 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.95 -53.93 18.11 Favored 'General case' 0 C--N 1.374 1.635 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 -178.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.87 -28.28 67.4 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 130.031 3.332 . . . . 0.0 115.78 -176.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 m -87.76 -3.3 58.96 Favored 'General case' 0 C--N 1.359 0.98 0 C-N-CA 128.881 2.872 . . . . 0.0 113.452 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.477 3.8 t-20 106.16 81.78 0.0 OUTLIER 'General case' 0 C--N 1.353 0.727 0 C-N-CA 129.393 3.077 . . . . 0.0 116.113 177.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.12 71.04 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 126.454 1.902 . . . . 0.0 114.426 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 158.96 -22.87 0.31 Allowed Glycine 0 CA--C 1.487 -1.663 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.641 167.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.287 0.2 OUTLIER -117.76 -81.28 0.62 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.165 0.983 . . . . 0.0 113.338 -176.507 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.5 p -115.81 31.2 6.86 Favored 'General case' 0 CA--C 1.502 -0.866 0 C-N-CA 126.119 1.768 . . . . 0.0 111.363 -168.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.58 92.22 1.79 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 129.611 3.481 . . . . 0.0 109.744 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . 0.256 29.5 mmt180 120.13 -32.02 0.01 OUTLIER 'General case' 0 C--N 1.38 1.93 0 C-N-CA 128.607 2.763 . . . . 0.0 105.391 -170.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.3 m -76.11 62.44 1.69 Allowed 'General case' 0 C--N 1.363 1.16 0 C-N-CA 126.558 1.943 . . . . 0.0 115.96 -174.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 9.8 mmt -92.55 85.97 5.47 Favored 'General case' 0 C--N 1.356 0.856 0 C-N-CA 126.575 1.95 . . . . 0.0 111.591 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.5 63.31 0.61 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 126.546 1.938 . . . . 0.0 108.568 -177.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 52.4 m -178.48 -74.74 0.01 OUTLIER 'General case' 0 C--N 1.35 0.595 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.603 0.3 OUTLIER 80.67 37.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.358 0.96 0 CA-C-O 126.201 2.905 . . . . 0.0 114.992 177.262 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 71.0 m -158.65 54.8 0.43 Allowed 'General case' 0 CA--C 1.515 -0.376 1 N-CA-C 100.038 -4.06 . . . . 0.0 100.038 173.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.388 0.8 OUTLIER -93.5 161.21 14.46 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 -163.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.94 40.77 0.03 OUTLIER 'General case' 0 C--N 1.35 0.623 1 C-N-CA 135.318 5.447 . . . . 0.0 121.082 -173.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.531 ' CE2' HD12 ' A' ' 62' ' ' LEU . 2.5 m-85 -39.68 -33.49 0.19 Allowed 'General case' 0 N--CA 1.476 0.845 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 -164.24 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.85 -34.46 73.15 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 128.752 2.821 . . . . 0.0 116.044 176.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.2 m -85.5 -6.65 59.17 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 126.608 1.963 . . . . 0.0 115.073 -177.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -97.55 -90.76 0.26 Allowed 'General case' 0 C--N 1.355 0.836 0 O-C-N 120.064 -1.647 . . . . 0.0 115.178 -173.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.444 HG12 HD22 ' A' ' 63' ' ' LEU . 1.2 pp -11.35 139.41 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.578 2 C-N-CA 135.096 5.358 . . . . 0.0 123.648 178.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.45 150.98 87.12 Favored 'Trans proline' 0 C--N 1.364 1.385 1 C-N-CA 125.354 4.036 . . . . 0.0 119.332 -168.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.3 t -46.05 -35.78 5.15 Favored 'General case' 0 C--N 1.374 1.634 1 C-N-CA 132.878 4.471 . . . . 0.0 118.265 -178.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.0 m -85.16 -51.51 6.58 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 125.998 1.719 . . . . 0.0 110.539 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.449 HG22 ' CD1' ' A' ' 91' ' ' PHE 0.299 0.3 OUTLIER -64.53 -38.16 81.9 Favored 'Isoleucine or valine' 0 C--N 1.369 1.423 0 C-N-CA 126.103 1.761 . . . . 0.0 111.011 -174.399 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 42.2 tp -59.08 -26.83 64.98 Favored 'General case' 0 CA--C 1.557 1.23 0 O-C-N 118.913 -2.367 . . . . 0.0 115.771 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -79.38 -28.82 41.92 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 119.496 -2.003 . . . . 0.0 110.37 169.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.371 7.0 mmtt -67.62 -12.09 59.65 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 130.756 3.622 . . . . 0.0 113.803 167.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 64' ' ' VAL . 1.3 tm? -56.36 -40.19 74.12 Favored 'General case' 0 C--N 1.385 2.14 0 C-N-CA 126.721 2.009 . . . . 0.0 111.477 166.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -81.46 -26.7 0.43 Allowed Pre-proline 0 C--N 1.356 0.863 1 N-CA-C 122.194 4.146 . . . . 0.0 122.194 -175.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -68.7 -8.71 24.09 Favored 'Trans proline' 0 CA--C 1.55 1.298 1 CA-C-N 131.88 5.279 . . . . 0.0 117.477 -178.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.478 ' HB3' HG23 ' A' ' 88' ' ' VAL . 0.1 OUTLIER -20.86 -141.67 0.0 OUTLIER 'General case' 0 C--N 1.375 1.68 2 C-N-CA 134.396 5.079 . . . . 0.0 122.993 178.382 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.524 ' HE ' ' HG2' ' A' ' 134' ' ' LYS 0.332 9.3 ptm180 -85.23 -66.66 0.87 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 119.562 -1.962 . . . . 0.0 114.055 176.083 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.524 ' HG2' ' HE ' ' A' ' 133' ' ' ARG . 4.7 mmmp? -81.03 39.57 0.5 Allowed 'General case' 0 C--N 1.37 1.464 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -177.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 15.0 tpt -92.09 -49.66 6.09 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 128.179 2.592 . . . . 0.0 109.18 174.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . 0.259 . . 93.74 36.84 0.01 OUTLIER 'General case' 0 C--N 1.363 1.189 0 C-N-CA 129.324 3.05 . . . . 0.0 112.911 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 . . . . . 0 C--N 1.362 1.114 0 C-N-CA 125.235 1.414 . . . . 0.0 109.162 176.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -59.16 -35.39 73.44 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 127.947 2.499 . . . . 0.0 116.598 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.3 m -72.49 -44.07 62.31 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 126.556 1.942 . . . . 0.0 113.434 174.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -68.82 -28.94 67.19 Favored 'General case' 0 C--N 1.375 1.687 0 C-N-CA 126.992 2.117 . . . . 0.0 113.994 174.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -55.98 -28.48 57.34 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 127.175 2.19 . . . . 0.0 115.846 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 tt -70.04 -49.48 50.87 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.237 2.615 . . . . 0.0 114.049 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -9.26 51.14 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 120.049 -1.657 . . . . 0.0 113.724 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -62.24 -13.93 33.1 Favored 'General case' 0 C--N 1.38 1.901 0 C-N-CA 127.968 2.507 . . . . 0.0 114.061 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.283 19.1 pt -127.76 -67.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 177.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 13.3 m -91.23 70.22 6.14 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 127.375 2.27 . . . . 0.0 107.926 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 166.86 -63.98 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.589 -2.745 . . . . 0.0 103.589 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -66.1 -132.51 0.0 OUTLIER 'General case' 0 C--N 1.378 1.841 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 174.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -86.28 -40.42 15.54 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 117.445 -3.284 . . . . 0.0 118.189 -166.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -6.84 3.67 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 128.792 2.837 . . . . 0.0 116.316 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.09 -32.24 72.77 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 129.783 3.233 . . . . 0.0 110.546 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -72.3 -47.6 48.7 Favored 'General case' 0 C--N 1.368 1.375 0 O-C-N 120.696 -1.253 . . . . 0.0 112.468 168.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -62.87 -49.23 75.67 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 125.236 1.414 . . . . 0.0 114.618 176.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.644 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.524 0.0 OUTLIER -69.78 -51.28 35.22 Favored 'General case' 0 C--N 1.378 1.826 0 CA-C-N 120.854 1.661 . . . . 0.0 113.654 179.139 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL 0.599 0.2 OUTLIER -46.01 -32.45 2.8 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 162.331 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.5 -32.14 73.0 Favored 'General case' 0 CA--C 1.588 2.438 0 O-C-N 117.591 -3.193 . . . . 0.0 117.211 168.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -25.18 64.41 Favored 'General case' 0 C--N 1.382 1.994 0 O-C-N 117.992 -2.943 . . . . 0.0 112.065 171.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.515 HG21 ' HB ' ' A' ' 92' ' ' VAL 0.481 0.7 OUTLIER -73.84 -50.25 5.67 Favored Pre-proline 0 C--N 1.363 1.183 1 CA-C-O 109.88 -4.867 . . . . 0.0 115.871 173.359 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -62.08 -19.59 66.86 Favored 'Trans proline' 0 C--N 1.373 1.819 2 CA-C-N 139.491 7.997 . . . . 0.0 112.553 164.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.23 -57.47 8.41 Favored 'General case' 0 CA--C 1.583 2.213 0 C-N-CA 116.604 -2.039 . . . . 0.0 115.676 164.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.75 -53.73 14.41 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 128.608 2.763 . . . . 0.0 115.346 175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.277 0.8 OUTLIER -69.94 -31.69 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 C-N-CA 127.001 2.12 . . . . 0.0 113.494 179.166 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.536 6.3 tm-20 -77.54 -36.82 51.96 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-N 122.481 2.401 . . . . 0.0 109.562 175.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -57.76 -55.97 27.95 Favored 'General case' 0 C--N 1.388 2.264 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.76 -44.46 64.0 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 130.92 3.688 . . . . 0.0 116.925 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.321 3.1 ttpm? -75.75 -35.75 60.08 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 117.427 2.38 . . . . 0.0 117.427 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.1 -22.66 11.54 Favored 'General case' 0 C--N 1.385 2.142 0 C-N-CA 129.08 2.952 . . . . 0.0 113.922 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -58.37 -19.14 33.18 Favored 'General case' 0 N--CA 1.441 -0.876 1 C-N-CA 132.666 4.386 . . . . 0.0 115.389 170.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.56 20.95 17.65 Favored 'General case' 0 C--N 1.367 1.368 0 N-CA-C 118.472 2.767 . . . . 0.0 118.472 -175.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 99.47 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.362 1.112 0 CA-C-N 121.497 1.953 . . . . 0.0 113.387 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.58 129.61 73.74 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 128.808 2.843 . . . . 0.0 114.236 -177.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -82.69 -26.4 2.55 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.598 2.865 . . . . 0.0 111.83 172.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.457 9.7 p90 43.3 60.06 2.72 Favored 'General case' 0 C--N 1.377 1.803 1 C-N-CA 131.779 4.032 . . . . 0.0 115.783 -175.135 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.9 mm -112.58 150.32 14.82 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 C-N-CA 127.55 2.34 . . . . 0.0 106.375 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -102.08 179.29 4.36 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.56 1.544 . . . . 0.0 111.774 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -76.73 -11.6 59.86 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 116.187 1.921 . . . . 0.0 116.187 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -101.73 -11.11 19.38 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.675 2.39 . . . . 0.0 109.33 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 90.56 20.63 40.14 Favored Glycine 0 C--N 1.361 1.927 0 C-N-CA 128.095 2.76 . . . . 0.0 117.352 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -92.69 168.26 11.33 Favored 'General case' 0 C--N 1.359 1.008 0 CA-C-N 118.856 1.328 . . . . 0.0 107.457 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -85.92 146.12 26.85 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 126.121 1.768 . . . . 0.0 109.378 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 t -113.91 143.14 45.2 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -165.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 mp -117.71 117.44 35.84 Favored Pre-proline 0 C--N 1.376 1.739 0 C-N-CA 126.166 1.787 . . . . 0.0 113.989 -172.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 132' ' ' TYR . 2.3 Cg_endo -71.3 175.23 9.61 Favored 'Trans proline' 0 C--N 1.373 1.828 1 C-N-CA 127.779 5.653 . . . . 0.0 113.165 166.18 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.6 t -69.7 -50.2 46.06 Favored 'General case' 0 C--N 1.368 1.402 0 N-CA-C 117.393 2.368 . . . . 0.0 117.393 -176.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.49 -28.09 73.22 Favored Glycine 0 N--CA 1.51 3.599 0 CA-C-O 124.47 2.15 . . . . 0.0 113.682 175.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.273 24.1 t -78.96 -23.52 12.82 Favored 'Isoleucine or valine' 0 C--N 1.355 0.847 0 C-N-CA 126.126 1.77 . . . . 0.0 111.446 172.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.3 OUTLIER -68.94 -43.12 75.74 Favored 'General case' 0 C--N 1.37 1.485 0 O-C-N 119.542 -1.974 . . . . 0.0 112.35 174.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.9 tt -65.51 -36.67 78.2 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE2' HD23 ' A' ' 129' ' ' LEU . 45.6 t80 -61.63 -58.43 8.13 Favored 'General case' 0 C--N 1.378 1.846 0 O-C-N 121.274 -0.891 . . . . 0.0 112.957 170.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.515 ' HB ' HG21 ' A' ' 60' ' ' VAL . 35.4 m -61.17 -56.98 14.28 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 C-N-CA 127.059 2.144 . . . . 0.0 115.768 -173.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.29 68.36 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 126.887 2.075 . . . . 0.0 116.088 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 71.2 mttt -76.03 -27.76 57.46 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-N 121.503 1.956 . . . . 0.0 115.385 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.19 82.53 Favored 'General case' 0 C--N 1.369 1.419 0 C-N-CA 128.39 2.676 . . . . 0.0 113.633 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.644 ' HB1' ' HB2' ' A' ' 56' ' ' LEU 0.262 . . -78.43 -35.02 47.46 Favored 'General case' 0 N--CA 1.41 -2.447 0 CA-C-N 113.143 -1.844 . . . . 0.0 113.386 -176.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . 0.259 0.3 OUTLIER -71.91 -23.27 61.45 Favored 'General case' 0 C--N 1.376 1.718 0 O-C-N 120.647 -1.283 . . . . 0.0 112.16 171.484 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -73.71 -55.3 6.42 Favored 'General case' 0 C--N 1.366 1.293 0 C-N-CA 125.575 1.55 . . . . 0.0 112.332 173.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 27.1 t80 -71.82 -44.49 63.83 Favored 'General case' 0 C--N 1.364 1.204 0 N-CA-C 117.998 2.592 . . . . 0.0 117.998 178.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -75.2 -27.68 59.69 Favored 'General case' 0 C--N 1.351 0.657 0 O-C-N 119.569 -1.957 . . . . 0.0 115.231 -173.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 73.6 p -78.05 -57.67 3.67 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 124.878 1.271 . . . . 0.0 113.228 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.462 ' HA ' ' O ' ' A' ' 107' ' ' GLY 0.465 2.3 t-20 175.67 85.31 0.0 OUTLIER 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.332 2.253 . . . . 0.0 113.696 170.095 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.14 79.7 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 169.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.36 -9.34 3.5 Favored Glycine 0 C--N 1.36 1.915 0 CA-C-N 116.431 -0.35 . . . . 0.0 112.981 168.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.464 ' CD1' ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -105.0 -81.77 0.53 Allowed 'General case' 0 C--N 1.351 0.646 0 O-C-N 120.895 -1.356 . . . . 0.0 111.387 -175.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.464 ' H ' ' CD1' ' A' ' 105' ' ' LEU . 6.8 t -129.74 24.84 5.37 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 126.654 1.982 . . . . 0.0 110.308 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' ' 102' ' ' ASN . . . -88.1 68.93 2.91 Favored Glycine 0 C--N 1.346 1.09 0 O-C-N 120.718 -1.239 . . . . 0.0 113.42 -167.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.419 HH11 HD21 ' A' ' 102' ' ' ASN . 26.2 ptt-85 -161.96 32.35 0.12 Allowed 'General case' 0 C--N 1.35 0.592 0 CA-C-N 120.062 1.931 . . . . 0.0 106.622 -178.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 64.8 m 73.94 79.19 0.12 Allowed 'General case' 0 C--N 1.365 1.27 0 C-N-CA 127.499 2.32 . . . . 0.0 113.875 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.27 112.69 24.46 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -76.6 -21.14 55.96 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 118.473 2.768 . . . . 0.0 118.473 -169.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.5 t -128.37 49.26 2.2 Favored 'General case' 0 C--N 1.348 0.543 0 C-N-CA 124.955 1.302 . . . . 0.0 108.795 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 p -118.16 4.67 7.05 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 O-C-N 121.34 -0.85 . . . . 0.0 112.222 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.5 m 74.58 48.83 0.11 Allowed 'General case' 0 C--N 1.369 1.415 0 C-N-CA 127.723 2.409 . . . . 0.0 108.216 -170.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -62.49 63.98 0.01 OUTLIER 'General case' 0 C--N 1.364 1.208 0 C-N-CA 130.898 3.679 . . . . 0.0 117.1 -168.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.462 HD22 ' HA ' ' A' ' 116' ' ' ASN . 4.8 m120 -120.36 125.93 49.24 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-O 123.444 1.592 . . . . 0.0 113.376 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -77.16 0.69 20.76 Favored 'General case' 0 N--CA 1.446 -0.644 1 C-N-CA 133.588 4.755 . . . . 0.0 112.895 175.416 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.99 -11.77 49.48 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 129.485 3.114 . . . . 0.0 108.871 171.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.278 12.5 t -136.44 -37.93 0.68 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 125.175 1.39 . . . . 0.0 111.743 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -115.55 100.52 8.12 Favored 'General case' 0 C--N 1.368 1.385 0 CA-C-N 122.046 2.203 . . . . 0.0 114.952 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.454 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.259 0.3 OUTLIER -159.86 169.1 10.86 Favored Pre-proline 0 C--N 1.38 1.918 0 C-N-CA 127.165 2.186 . . . . 0.0 108.755 177.991 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.558 ' HG2' HD11 ' A' ' 125' ' ' ILE . 18.7 Cg_exo -63.95 144.91 89.27 Favored 'Trans proline' 0 C--N 1.387 2.579 1 C-N-CA 125.622 4.214 . . . . 0.0 118.868 -173.642 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.3 t -76.18 -13.62 60.18 Favored 'General case' 0 C--N 1.375 1.678 0 C-N-CA 127.275 2.23 . . . . 0.0 114.549 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 29.0 m -86.17 -57.1 3.15 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 126.286 1.834 . . . . 0.0 112.315 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.558 HD11 ' HG2' ' A' ' 122' ' ' PRO 0.581 1.7 pp -70.67 -27.78 32.04 Favored 'Isoleucine or valine' 0 C--N 1.368 1.41 0 N-CA-C 116.961 2.208 . . . . 0.0 116.961 -177.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.325 0.3 OUTLIER -55.05 -26.38 37.12 Favored 'General case' 0 C--N 1.369 1.417 0 O-C-N 117.706 -3.121 . . . . 0.0 114.902 177.689 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -69.03 -27.45 65.68 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 125.904 1.682 . . . . 0.0 113.298 167.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -82.17 -14.2 56.0 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 129.648 3.179 . . . . 0.0 112.759 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.506 HD23 ' CE2' ' A' ' 91' ' ' PHE . 3.0 tm? -56.74 -24.76 52.1 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 118.706 -2.496 . . . . 0.0 114.111 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -92.14 -36.11 0.35 Allowed Pre-proline 0 CA--C 1.552 1.029 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -176.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -58.19 -8.23 4.71 Favored 'Trans proline' 0 C--N 1.367 1.536 2 CA-C-N 131.473 5.133 . . . . 0.0 120.554 -167.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 85' ' ' PRO . 0.9 OUTLIER -87.28 -84.1 0.19 Allowed 'General case' 0 C--N 1.367 1.326 0 N-CA-C 104.794 -2.299 . . . . 0.0 104.794 169.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.418 ' N ' ' CD2' ' A' ' 132' ' ' TYR 0.345 48.5 mtp180 24.02 66.13 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.588 1 C-N-CA 132.318 4.247 . . . . 0.0 117.775 -177.436 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.312 30.7 mmmt 82.19 47.02 0.02 OUTLIER 'General case' 0 C--N 1.367 1.343 0 C-N-CA 128.487 2.715 . . . . 0.0 111.897 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.2 ttt -62.37 -27.09 68.83 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.937 3.295 . . . . 0.0 116.688 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -164.33 167.8 19.38 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 104.669 -2.345 . . . . 0.0 104.669 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 . . . . . 0 C--N 1.357 0.907 0 N-CA-C 106.603 -1.629 . . . . 0.0 106.603 179.056 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -86.53 -2.59 58.6 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.77 2.428 . . . . 0.0 115.888 -176.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 14.2 t -67.34 -54.19 26.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.2 0 C-N-CA 127.255 2.222 . . . . 0.0 114.352 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -68.73 -27.33 65.84 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 129.581 3.152 . . . . 0.0 112.421 173.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -25.75 17.33 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 119.796 3.258 . . . . 0.0 119.796 -174.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.4 mp -78.03 -51.13 10.81 Favored 'General case' 0 C--N 1.366 1.3 0 O-C-N 120.667 -1.271 . . . . 0.0 114.26 178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.95 2.59 30.01 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 130.602 3.561 . . . . 0.0 112.395 174.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -84.77 -14.63 47.62 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.733 1.613 . . . . 0.0 109.553 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.413 HG22 ' HB2' ' A' ' 52' ' ' HIS . 1.2 mt -90.71 56.67 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-O 123.682 1.706 . . . . 0.0 112.479 -171.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.5 m 91.23 -52.22 0.02 OUTLIER 'General case' 0 C--N 1.372 1.562 1 C-N-CA 131.823 4.049 . . . . 0.0 106.567 -169.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 162.56 79.23 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.352 1 C-N-CA 135.177 5.391 . . . . 0.0 100.827 173.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.384 2.6 p30 33.91 34.78 0.01 OUTLIER 'General case' 0 C--N 1.381 1.95 0 N-CA-C 120.995 3.702 . . . . 0.0 120.995 -174.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -87.36 -55.74 3.67 Favored 'General case' 0 C--N 1.358 0.965 0 C-N-CA 128.125 2.57 . . . . 0.0 112.041 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.413 ' HB2' HG22 ' A' ' 47' ' ' ILE . 12.5 m-70 -68.85 43.7 0.04 OUTLIER 'General case' 0 C--N 1.363 1.163 1 C-N-CA 132.103 4.161 . . . . 0.0 115.64 -177.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -68.78 -36.53 78.41 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.766 2.026 . . . . 0.0 110.066 174.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.87 -38.49 70.04 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 128.79 2.836 . . . . 0.0 114.155 173.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -77.0 -36.12 56.62 Favored 'General case' 0 C--N 1.378 1.842 0 O-C-N 120.83 -1.169 . . . . 0.0 112.961 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 93' ' ' ALA . 0.2 OUTLIER -72.68 -52.37 15.53 Favored 'General case' 0 C--N 1.368 1.386 0 CA-C-O 117.636 -1.173 . . . . 0.0 113.815 169.008 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.594 HG23 HD23 ' A' ' 56' ' ' LEU 0.638 71.9 p -59.31 -50.26 74.67 Favored 'General case' 0 C--N 1.367 1.368 0 CA-C-O 111.883 -3.913 . . . . 0.0 118.729 172.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -49.26 -38.83 28.27 Favored 'General case' 0 N--CA 1.5 2.075 1 CA-C-N 128.016 4.916 . . . . 0.0 119.612 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . 0.273 60.6 mtp -47.61 -51.52 21.01 Favored 'General case' 0 C--N 1.376 1.735 0 C-N-CA 130.981 3.712 . . . . 0.0 111.705 170.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.609 0.2 OUTLIER -73.45 -53.32 4.63 Favored Pre-proline 0 C--O 1.207 -1.18 1 CA-C-O 107.396 -6.049 . . . . 0.0 115.657 179.933 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -53.8 -15.81 7.53 Favored 'Trans proline' 0 C--N 1.379 2.184 2 CA-C-N 139.474 7.991 . . . . 0.0 116.429 166.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.376 1.733 0 CA-C-N 122.373 2.351 . . . . 0.0 113.098 159.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.4 tp -75.06 -45.0 44.48 Favored 'General case' 0 C--N 1.37 1.458 0 N-CA-C 117.552 2.427 . . . . 0.0 117.552 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.82 -37.02 72.3 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.259 0 C-N-CA 129.754 3.221 . . . . 0.0 111.55 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.458 84.0 mt-10 -78.2 -37.66 45.05 Favored 'General case' 0 C--N 1.357 0.907 0 O-C-N 119.172 -2.205 . . . . 0.0 109.729 177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -55.75 30.87 Favored 'General case' 0 C--N 1.389 2.304 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 169.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 129' ' ' LEU 0.318 . . -72.12 -38.17 69.33 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 131.088 3.755 . . . . 0.0 118.454 177.107 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' CD2' ' A' ' 132' ' ' TYR 0.496 3.5 tmtt? -69.99 -21.81 63.19 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 119.536 -1.978 . . . . 0.0 111.724 172.296 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -60.46 -23.29 64.34 Favored 'General case' 0 C--N 1.383 2.022 0 O-C-N 120.144 -1.598 . . . . 0.0 114.35 175.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -71.8 -10.99 60.59 Favored 'General case' 0 C--N 1.365 1.275 1 C-N-CA 131.908 4.083 . . . . 0.0 113.78 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.3 t -85.03 20.85 1.76 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.17 2.188 . . . . 0.0 112.826 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 80.11 -23.41 0.24 Allowed 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.419 2.287 . . . . 0.0 116.32 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.59 160.15 27.3 Favored Pre-proline 0 C--N 1.349 0.559 0 C-N-CA 129.387 3.075 . . . . 0.0 115.469 -172.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -89.62 17.61 1.54 Allowed 'Trans proline' 0 CA--C 1.553 1.466 0 C-N-CA 124.362 3.374 . . . . 0.0 113.051 171.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.434 2.9 p90 41.62 45.99 3.04 Favored 'General case' 0 C--N 1.38 1.914 1 C-N-CA 132.14 4.176 . . . . 0.0 116.966 -179.833 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.4 mm -83.26 142.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 C-N-CA 127.44 2.296 . . . . 0.0 114.156 -175.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -116.45 177.13 4.81 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.508 1.923 . . . . 0.0 110.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -41.28 -25.0 0.03 OUTLIER 'General case' 0 C--N 1.365 1.249 2 C-N-CA 132.268 4.227 . . . . 0.0 122.339 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -101.58 -9.74 20.71 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 119.85 -1.781 . . . . 0.0 110.355 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.5 32.7 12.83 Favored Glycine 0 C--N 1.358 1.781 0 C-N-CA 129.523 3.439 . . . . 0.0 112.332 -171.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -94.83 163.91 13.15 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.875 2.07 . . . . 0.0 109.492 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -79.32 152.91 30.21 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 128.493 2.717 . . . . 0.0 111.023 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -152.36 159.07 43.49 Favored 'General case' 0 C--N 1.369 1.43 0 O-C-N 120.376 -1.452 . . . . 0.0 114.779 -162.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -132.73 103.53 13.27 Favored Pre-proline 0 C--N 1.376 1.73 0 C-N-CA 129.834 3.254 . . . . 0.0 108.803 -174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.27 175.81 7.21 Favored 'Trans proline' 0 C--N 1.362 1.284 1 C-N-CA 125.955 4.437 . . . . 0.0 115.981 176.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.7 p -48.74 -50.91 31.64 Favored 'General case' 0 C--N 1.367 1.329 0 N-CA-C 119.852 3.279 . . . . 0.0 119.852 -173.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.81 -31.61 58.03 Favored Glycine 0 N--CA 1.501 2.977 0 CA-C-O 123.876 1.82 . . . . 0.0 114.152 176.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.493 0.5 OUTLIER -77.93 -23.14 13.84 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 O-C-N 119.904 -1.939 . . . . 0.0 112.196 177.665 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.466 ' HA ' HG22 ' A' ' 92' ' ' VAL . 10.0 tp -70.24 -36.89 74.81 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 130.099 3.359 . . . . 0.0 112.031 169.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.291 0.1 OUTLIER -63.84 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.387 2.23 0 O-C-N 120.688 -1.257 . . . . 0.0 112.754 168.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE2' HD23 ' A' ' 129' ' ' LEU . 42.1 t80 -63.95 -42.1 97.4 Favored 'General case' 0 C--N 1.381 1.936 0 C-N-CA 126.461 1.904 . . . . 0.0 111.252 171.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.492 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.388 10.2 m -60.42 -62.58 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.373 1.596 0 CA-C-N 122.115 2.234 . . . . 0.0 114.6 176.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.65 -49.73 61.72 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 169.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.607 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.485 62.1 mttt -75.28 -27.68 59.46 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 116.78 2.141 . . . . 0.0 116.78 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 91' ' ' PHE . . . -61.41 -56.36 21.15 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 127.962 2.505 . . . . 0.0 113.303 174.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.406 ' HB3' ' HG ' ' A' ' 56' ' ' LEU . . . -78.12 -30.92 49.64 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.911 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.257 13.5 pt20 -69.63 -23.89 63.56 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 121.455 1.934 . . . . 0.0 112.764 169.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -73.58 -55.85 5.78 Favored 'General case' 0 C--N 1.371 1.532 0 CA-C-O 121.907 0.86 . . . . 0.0 112.296 169.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 121' ' ' ILE . 2.2 t80 -71.64 -42.78 67.15 Favored 'General case' 0 C--N 1.363 1.176 0 N-CA-C 119.886 3.291 . . . . 0.0 119.886 -176.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.7 ttm -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.369 1.428 0 C-N-CA 126.252 1.821 . . . . 0.0 114.316 -175.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . 0.321 2.4 t -71.39 -7.95 50.57 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 114.379 1.251 . . . . 0.0 114.379 173.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.358 0.1 OUTLIER -77.42 -10.21 59.33 Favored 'General case' 0 C--N 1.387 2.219 0 O-C-N 120.554 -1.341 . . . . 0.0 110.152 167.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.04 16.69 17.24 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 120.539 -1.351 . . . . 0.0 114.42 174.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -88.03 -11.9 66.75 Favored Glycine 0 C--N 1.362 1.974 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 154.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.4 4.0 pp -118.4 -51.89 2.39 Favored 'General case' 0 C--N 1.368 1.386 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 177.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.2 m -89.53 28.14 1.35 Allowed 'General case' 0 C--N 1.369 1.428 0 C-N-CA 129.632 3.173 . . . . 0.0 106.863 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.96 -32.41 53.16 Favored Glycine 0 C--N 1.353 1.519 0 C-N-CA 129.186 3.279 . . . . 0.0 116.285 -164.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -104.36 -9.27 18.62 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 126.938 2.095 . . . . 0.0 111.808 177.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.8 p -125.82 25.89 6.76 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.095 1.758 . . . . 0.0 111.967 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 88.3 mtp -18.29 33.86 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 2 C-N-CA 135.956 5.703 . . . . 0.0 124.32 -176.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.8 t70 80.95 -64.91 0.16 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 130.889 3.675 . . . . 0.0 110.204 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 17.3 p -133.99 -66.78 0.61 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 100.908 -3.738 . . . . 0.0 100.908 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.36 2.5 p 115.29 128.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.948 1 C-N-CA 132.644 4.378 . . . . 0.0 105.781 174.545 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 5.3 t 79.03 44.15 0.06 Allowed 'General case' 0 C--N 1.37 1.478 0 C-N-CA 125.218 1.407 . . . . 0.0 109.599 -174.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -85.04 168.2 15.13 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 129.681 3.192 . . . . 0.0 115.362 -173.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -116.62 140.43 49.4 Favored 'General case' 0 C--N 1.359 0.997 0 O-C-N 120.562 -1.336 . . . . 0.0 107.788 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.96 -7.28 54.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 127.81 2.444 . . . . 0.0 116.187 -168.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.3 -8.85 54.5 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 128.587 2.755 . . . . 0.0 111.544 172.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.253 4.3 t -119.62 23.76 10.99 Favored 'General case' 0 C--N 1.361 1.068 0 C-N-CA 126.414 1.886 . . . . 0.0 108.184 176.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -164.78 -166.98 1.13 Allowed 'General case' 0 C--N 1.369 1.43 0 C-N-CA 125.769 1.628 . . . . 0.0 110.307 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.611 0.7 OUTLIER 80.89 163.83 0.12 Allowed Pre-proline 0 C--N 1.374 1.636 1 C-N-CA 131.825 4.05 . . . . 0.0 115.685 -179.835 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 74.5 Cg_endo -67.66 135.11 34.79 Favored 'Trans proline' 0 C--N 1.38 2.233 0 CA-C-N 127.495 3.713 . . . . 0.0 116.655 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 10.3 m -58.86 -24.46 62.17 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 129.892 3.277 . . . . 0.0 115.463 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -75.13 -47.38 28.86 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.225 2.21 . . . . 0.0 113.687 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.35 0.6 OUTLIER -70.91 -28.14 32.59 Favored 'Isoleucine or valine' 0 C--N 1.377 1.764 0 C-N-CA 126.449 1.9 . . . . 0.0 111.919 177.081 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.52 -27.03 62.22 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 128.437 2.695 . . . . 0.0 114.035 171.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -73.41 -23.73 60.18 Favored 'General case' 0 C--N 1.365 1.253 0 C-N-CA 126.061 1.745 . . . . 0.0 112.494 169.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -84.38 -16.99 40.84 Favored 'General case' 0 C--N 1.374 1.65 0 C-N-CA 128.544 2.738 . . . . 0.0 112.746 172.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.537 HD11 ' HB1' ' A' ' 67' ' ' ALA . 1.7 tm? -59.87 -42.03 92.81 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.052 -1.655 . . . . 0.0 113.234 170.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.13 -35.06 0.88 Allowed Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 129.646 3.178 . . . . 0.0 119.474 -173.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -59.72 -6.62 4.72 Favored 'Trans proline' 0 C--N 1.37 1.661 1 C-N-CA 127.429 5.419 . . . . 0.0 115.674 168.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.518 ' CD2' ' HG2' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -39.97 -160.47 0.0 OUTLIER 'General case' 0 C--N 1.371 1.521 1 C-N-CA 133.542 4.737 . . . . 0.0 118.396 174.841 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -61.65 -31.29 71.39 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 119.751 3.241 . . . . 0.0 119.751 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -18.17 50.88 Favored 'General case' 0 C--N 1.384 2.082 0 CA-C-N 122.07 2.213 . . . . 0.0 115.234 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 20.4 mmt -90.71 -6.95 53.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 129.496 3.118 . . . . 0.0 114.083 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.01 54.39 1.89 Allowed 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.249 1.82 . . . . 0.0 113.944 178.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--N 1.353 0.719 0 C-N-CA 125.986 1.715 . . . . 0.0 109.128 -177.013 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 68.62 -51.33 0.57 Allowed 'General case' 0 C--N 1.363 1.186 0 C-N-CA 128.246 2.619 . . . . 0.0 115.717 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.7 m -60.78 -34.34 58.73 Favored 'Isoleucine or valine' 0 C--N 1.369 1.453 0 C-N-CA 129.921 3.288 . . . . 0.0 113.904 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.288 0.0 OUTLIER -62.87 -27.34 69.28 Favored 'General case' 0 C--N 1.366 1.317 0 C-N-CA 129.139 2.976 . . . . 0.0 114.777 173.022 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -66.31 -26.12 67.16 Favored 'General case' 0 C--N 1.368 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 114.181 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mp -71.84 -37.01 70.35 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.284 1.834 . . . . 0.0 114.808 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.35 -0.81 34.87 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 126.653 1.981 . . . . 0.0 110.874 177.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -61.43 -14.25 26.82 Favored 'General case' 0 C--N 1.382 2.006 0 C-N-CA 129.464 3.106 . . . . 0.0 114.728 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.566 HG22 ' HB3' ' A' ' 52' ' ' HIS . 1.9 pt -123.79 -26.09 1.85 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.583 1 C-N-CA 131.956 4.102 . . . . 0.0 116.91 -171.439 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.07 61.12 1.45 Allowed 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.337 0.0 OUTLIER 175.58 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.47 -147.09 0.02 OUTLIER 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.485 2.314 . . . . 0.0 112.903 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -86.8 -33.92 19.73 Favored 'General case' 0 C--N 1.356 0.85 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 -167.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.566 ' HB3' HG22 ' A' ' 47' ' ' ILE . 60.3 m80 -65.81 5.58 0.45 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 129.511 3.124 . . . . 0.0 116.105 -176.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -68.38 -30.69 69.68 Favored 'General case' 0 C--N 1.376 1.757 0 C-N-CA 130.292 3.437 . . . . 0.0 112.149 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -73.37 -51.25 18.06 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 127.072 2.149 . . . . 0.0 109.966 169.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.325 29.9 t80 -67.53 -49.17 64.57 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.352 0.0 OUTLIER -71.49 -51.5 23.35 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 124.489 3.313 . . . . 0.0 113.711 177.247 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.403 0.2 OUTLIER -51.64 -33.79 35.0 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 172.596 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.66 -33.36 73.86 Favored 'General case' 0 C--N 1.375 1.686 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 173.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 26.8 mtp -49.1 -45.32 43.14 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-O 127.77 3.652 . . . . 0.0 112.18 174.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 HG23 ' A' ' 64' ' ' VAL 0.516 1.1 t -72.64 -59.21 2.5 Favored Pre-proline 0 C--O 1.208 -1.09 1 CA-C-O 109.186 -5.197 . . . . 0.0 115.037 179.676 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 0.267 31.6 Cg_exo -56.83 -15.4 16.56 Favored 'Trans proline' 0 C--N 1.377 2.051 3 CA-C-N 137.533 7.297 . . . . 0.0 117.025 168.901 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.0 mt -59.5 -49.06 79.25 Favored 'General case' 0 C--N 1.378 1.825 0 CA-C-N 122.212 2.278 . . . . 0.0 111.825 159.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.23 -53.97 25.32 Favored 'General case' 0 C--N 1.375 1.696 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 169.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.542 HG23 HG12 ' A' ' 60' ' ' VAL . 32.7 t -63.86 -32.42 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 C-N-CA 130.158 3.383 . . . . 0.0 114.15 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' HA ' ' CE1' ' A' ' 75' ' ' PHE 0.439 10.9 tt0 -76.76 -44.76 31.75 Favored 'General case' 0 C--N 1.369 1.456 0 O-C-N 120.411 -1.431 . . . . 0.0 109.824 173.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -55.26 33.46 Favored 'General case' 0 C--N 1.386 2.152 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 173.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.84 66.36 Favored 'General case' 0 CA--C 1.5 -0.943 1 C-N-CA 133.169 4.587 . . . . 0.0 115.596 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.408 0.0 OUTLIER -75.42 -22.17 57.61 Favored 'General case' 0 C--N 1.37 1.489 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 178.728 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.35 -23.27 14.76 Favored 'General case' 0 C--N 1.383 2.039 0 C-N-CA 125.957 1.703 . . . . 0.0 114.228 175.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -18.94 64.59 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 131.115 3.766 . . . . 0.0 116.313 174.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.22 20.43 18.97 Favored 'General case' 0 C--N 1.369 1.42 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -168.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.319 52.6 m80 96.33 -40.7 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 127.578 2.351 . . . . 0.0 113.952 178.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.67 137.68 41.26 Favored Pre-proline 0 C--N 1.354 0.766 0 CA-C-O 116.478 -1.725 . . . . 0.0 112.51 -172.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.63 -21.14 2.89 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.155 3.236 . . . . 0.0 112.718 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 65' ' ' GLU 0.365 8.9 p90 39.48 39.72 0.51 Allowed 'General case' 0 C--N 1.374 1.668 0 C-N-CA 131.181 3.793 . . . . 0.0 118.89 -179.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 64.3 mt -117.67 148.83 20.2 Favored 'Isoleucine or valine' 0 C--N 1.354 0.78 0 C-N-CA 130.342 3.457 . . . . 0.0 102.975 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -105.99 -177.5 3.38 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 124.104 0.962 . . . . 0.0 112.578 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.51 -17.65 60.21 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 128.41 2.684 . . . . 0.0 117.796 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.39 -3.94 27.83 Favored 'General case' 0 C--N 1.361 1.073 0 O-C-N 120.313 -1.492 . . . . 0.0 109.32 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.5 33.28 48.45 Favored Glycine 0 C--N 1.363 2.059 0 C-N-CA 129.606 3.479 . . . . 0.0 115.793 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -104.93 167.42 9.72 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -68.53 136.77 53.66 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 127.271 2.228 . . . . 0.0 113.659 178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.1 t -136.57 97.52 3.58 Favored 'General case' 0 C--N 1.356 0.859 0 O-C-N 120.996 -1.065 . . . . 0.0 109.84 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 7.5 pt -118.0 134.69 23.29 Favored Pre-proline 0 C--N 1.359 0.996 0 O-C-N 120.413 -1.43 . . . . 0.0 111.274 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.45 -171.94 1.31 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 125.188 3.926 . . . . 0.0 113.586 172.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -48.25 -41.77 28.62 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.657 3.583 . . . . 0.0 119.547 -176.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.19 -41.68 30.83 Favored Glycine 0 N--CA 1.496 2.692 0 O-C-N 120.659 -1.276 . . . . 0.0 115.027 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.432 HG13 ' CG ' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -74.07 -23.91 19.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.547 0 O-C-N 119.534 -2.156 . . . . 0.0 110.821 179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' HA ' HG22 ' A' ' 92' ' ' VAL . 12.2 tp -70.36 -43.45 70.16 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 129.998 3.319 . . . . 0.0 113.638 175.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.271 35.5 pt -65.36 -29.64 47.8 Favored 'Isoleucine or valine' 0 C--N 1.381 1.947 0 C-N-CA 124.712 1.205 . . . . 0.0 112.024 171.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 129' ' ' LEU . 21.2 t80 -67.46 -54.17 22.53 Favored 'General case' 0 C--N 1.378 1.844 0 CA-C-O 117.082 -1.437 . . . . 0.0 112.151 167.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 89' ' ' LEU 0.369 17.3 m -53.29 -58.37 3.19 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 CA-C-N 122.959 2.618 . . . . 0.0 117.392 -177.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.2 -53.4 57.57 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.335 2.254 . . . . 0.0 115.961 171.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -75.28 -28.74 59.88 Favored 'General case' 0 C--N 1.374 1.661 0 CA-C-N 121.787 2.085 . . . . 0.0 115.034 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.61 -50.26 67.86 Favored 'General case' 0 C--N 1.367 1.349 0 C-N-CA 126.549 1.939 . . . . 0.0 115.907 176.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.407 ' HB2' ' CG2' ' A' ' 60' ' ' VAL 0.306 . . -80.14 -29.94 38.93 Favored 'General case' 0 C--N 1.369 1.444 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 177.568 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HG3' HD11 ' A' ' 47' ' ' ILE . 32.6 tt0 -57.78 -34.16 69.3 Favored 'General case' 0 C--N 1.38 1.92 0 C-N-CA 128.036 2.534 . . . . 0.0 111.632 170.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -72.33 -54.88 8.19 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.604 1.162 . . . . 0.0 111.212 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.482 ' CE2' ' HG2' ' A' ' 120' ' ' GLU . 3.4 t80 -70.36 -45.85 65.27 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -173.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.442 ' SD ' HG21 ' A' ' 47' ' ' ILE 0.597 2.9 ppp? -73.54 -25.1 60.25 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -87.6 -57.14 3.06 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.41 2.284 . . . . 0.0 107.189 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' A' ' 103' ' ' ALA . 13.2 t-20 14.16 -78.23 0.0 OUTLIER 'General case' 0 C--N 1.371 1.537 1 C-N-CA 134.677 5.191 . . . . 0.0 119.529 173.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' H ' ' HB3' ' A' ' 102' ' ' ASN . . . -105.58 -38.93 6.27 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 110.481 -3.054 . . . . 0.0 114.977 -175.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.48 46.94 Favored Glycine 0 C--N 1.365 2.177 0 C-N-CA 126.023 1.773 . . . . 0.0 115.712 174.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -116.89 -53.95 2.45 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 125.423 1.489 . . . . 0.0 112.443 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.9 t -108.25 35.63 3.09 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 129.142 2.977 . . . . 0.0 108.459 -177.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.18 3.29 59.98 Favored Glycine 0 N--CA 1.435 -1.433 0 C-N-CA 128.451 2.929 . . . . 0.0 114.136 -177.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -101.79 -154.38 0.48 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.4 p -93.42 118.79 31.75 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 120.387 -1.445 . . . . 0.0 107.743 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 86.8 mtp -71.84 -10.77 60.26 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.247 2.219 . . . . 0.0 115.3 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . 0.266 37.5 m-20 82.85 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.36 1.059 0 C-N-CA 130.599 3.56 . . . . 0.0 112.515 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 38.3 p -81.98 68.1 8.24 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.511 1.924 . . . . 0.0 112.8 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.32 5.61 10.43 Favored 'Isoleucine or valine' 0 C--N 1.348 0.532 0 C-N-CA 126.459 1.904 . . . . 0.0 109.757 -177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.1 m 64.69 36.29 8.33 Favored 'General case' 0 C--N 1.374 1.662 0 C-N-CA 129.5 3.12 . . . . 0.0 111.214 -175.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.519 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE 0.502 0.2 OUTLIER 5.79 76.35 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 1 C-N-CA 133.767 4.827 . . . . 0.0 121.154 -169.44 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -40.55 26.17 0.0 OUTLIER 'General case' 0 C--N 1.351 0.654 2 C-N-CA 136.56 5.944 . . . . 0.0 123.374 -178.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CZ ' ' CD1' ' A' ' 115' ' ' TYR 0.277 39.7 m-85 -61.12 -15.56 34.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 117.728 2.492 . . . . 0.0 117.728 -175.061 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.88 -27.18 68.69 Favored 'General case' 0 C--N 1.354 0.8 1 C-N-CA 132.758 4.423 . . . . 0.0 112.951 169.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.2 t -133.8 22.99 3.92 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 126.475 1.91 . . . . 0.0 108.472 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.482 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 1.1 tt0 -135.76 174.6 10.43 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.167 -1.419 . . . . 0.0 107.167 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.6 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.575 0.8 OUTLIER 76.87 159.75 0.15 Allowed Pre-proline 0 CA--C 1.558 1.26 0 C-N-CA 129.961 3.304 . . . . 0.0 113.018 -175.664 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.6 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 84.6 Cg_endo -68.61 135.32 32.96 Favored 'Trans proline' 0 C--N 1.369 1.658 0 CA-C-N 125.922 3.151 . . . . 0.0 116.032 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.78 -8.08 49.83 Favored 'General case' 0 C--N 1.367 1.354 0 C-N-CA 127.548 2.339 . . . . 0.0 115.59 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 91.2 m -78.35 -54.86 5.74 Favored 'General case' 0 C--N 1.368 1.373 0 C-N-CA 129.609 3.164 . . . . 0.0 111.561 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' HG2' ' A' ' 122' ' ' PRO 0.351 0.7 OUTLIER -70.16 -27.57 32.75 Favored 'Isoleucine or valine' 0 C--N 1.374 1.656 0 C-N-CA 127.054 2.142 . . . . 0.0 110.099 179.126 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 15.0 tp -50.9 -26.2 5.55 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 129.367 3.067 . . . . 0.0 115.408 173.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -71.66 -36.55 70.7 Favored 'General case' 0 C--N 1.366 1.323 0 O-C-N 119.518 -1.989 . . . . 0.0 111.74 169.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.256 25.0 mmtp -68.95 -14.25 62.93 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 130.366 3.466 . . . . 0.0 113.416 173.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 1.1 tm? -56.01 -26.36 48.32 Favored 'General case' 0 N--CA 1.513 2.679 0 C-N-CA 126.081 1.752 . . . . 0.0 113.378 164.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -93.62 -34.48 0.32 Allowed Pre-proline 0 CA--C 1.551 1.014 1 N-CA-C 122.372 4.212 . . . . 0.0 122.372 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -71.28 -33.42 11.32 Favored 'Trans proline' 0 C--N 1.363 1.311 1 CA-C-N 130.592 4.819 . . . . 0.0 118.942 -165.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 133' ' ' ARG . 0.6 OUTLIER -16.5 -84.26 0.0 OUTLIER 'General case' 0 C--N 1.369 1.454 1 N-CA-C 122.443 4.238 . . . . 0.0 122.443 178.24 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.507 ' N ' ' CG ' ' A' ' 132' ' ' TYR . 23.5 ttp85 -117.86 -39.76 3.07 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 126.785 2.034 . . . . 0.0 114.058 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -94.64 -20.71 19.34 Favored 'General case' 0 C--N 1.365 1.273 0 CA-C-N 121.315 1.87 . . . . 0.0 114.823 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 42.0 mtt 66.82 -60.06 0.36 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 127.181 2.192 . . . . 0.0 116.555 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 76.51 -52.57 0.59 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 130.214 3.406 . . . . 0.0 113.411 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.36 1.065 0 C-N-CA 126.325 1.85 . . . . 0.0 111.119 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.56 HE22 HH21 ' A' ' 43' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 121.405 0.622 . . . . 0.0 109.406 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.14 -27.68 68.9 Favored 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.57 2.748 . . . . 0.0 114.799 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 m -64.46 -33.78 65.17 Favored 'Isoleucine or valine' 0 C--N 1.365 1.243 0 C-N-CA 129.638 3.175 . . . . 0.0 112.724 173.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.274 37.3 mtmm -67.13 -27.0 66.95 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 128.413 2.685 . . . . 0.0 113.989 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.56 HH21 HE22 ' A' ' 39' ' ' GLN . 96.4 mtt180 -61.3 -24.98 66.8 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 126.575 1.95 . . . . 0.0 115.028 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.8 mt -68.91 -39.68 79.56 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.017 1.727 . . . . 0.0 113.401 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -108.74 -19.35 13.45 Favored 'General case' 0 C--N 1.352 0.711 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.2 t -82.08 -17.93 44.88 Favored 'General case' 0 C--N 1.372 1.558 0 CA-C-N 121.042 1.746 . . . . 0.0 113.496 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 1.3 pt -125.44 -81.41 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.703 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.184 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 p -76.96 70.54 3.39 Favored 'General case' 0 C--N 1.362 1.122 0 C-N-CA 129.458 3.103 . . . . 0.0 110.553 -179.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 2.5 m-80 170.2 -71.03 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 101.239 -3.615 . . . . 0.0 101.239 -174.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -62.39 -125.6 0.0 OUTLIER 'General case' 0 C--N 1.378 1.822 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 173.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -86.18 -4.66 59.21 Favored 'General case' 0 C--N 1.355 0.825 0 O-C-N 116.873 -3.642 . . . . 0.0 117.532 -165.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.72 1.88 16.92 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 118.219 2.674 . . . . 0.0 118.219 -164.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -61.25 -38.26 86.07 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 122.554 2.434 . . . . 0.0 114.974 177.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -72.8 -40.48 65.82 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 129.318 3.047 . . . . 0.0 113.399 169.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -76.57 -35.99 57.86 Favored 'General case' 0 C--N 1.368 1.393 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.573 ' O ' HG12 ' A' ' 60' ' ' VAL . 2.5 mp -64.67 -53.53 45.9 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-N 121.399 1.909 . . . . 0.0 110.684 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.822 14.5 p -48.32 -29.93 4.39 Favored 'General case' 0 C--O 1.216 -0.677 1 C-N-CA 133.952 4.901 . . . . 0.0 120.06 175.621 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -79.88 -45.55 18.43 Favored 'General case' 0 CA--C 1.575 1.919 0 C-N-CA 128.384 2.673 . . . . 0.0 116.025 171.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.7 mtp -52.32 -47.55 65.93 Favored 'General case' 0 C--N 1.38 1.911 0 C-N-CA 129.609 3.164 . . . . 0.0 113.839 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.678 HG13 ' HD3' ' A' ' 61' ' ' PRO 0.458 3.3 p -69.61 -44.25 23.89 Favored Pre-proline 0 N--CA 1.435 -1.188 0 CA-C-O 113.272 -3.251 . . . . 0.0 114.766 -178.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.678 ' HD3' HG13 ' A' ' 60' ' ' VAL . 50.6 Cg_exo -61.56 -19.97 66.84 Favored 'Trans proline' 0 C--N 1.363 1.297 2 CA-C-N 130.881 4.922 . . . . 0.0 115.168 161.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.3 mt -59.07 -46.02 89.32 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 123.999 3.091 . . . . 0.0 113.064 163.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.426 HD23 HG23 ' A' ' 60' ' ' VAL . 13.8 tp -63.36 -53.49 51.81 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 128.765 2.826 . . . . 0.0 116.222 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 61' ' ' PRO . 0.4 OUTLIER -73.13 -33.28 41.73 Favored 'Isoleucine or valine' 0 C--N 1.358 0.966 0 O-C-N 117.373 -3.33 . . . . 0.0 114.815 178.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.383 36.1 tt0 -73.26 -36.74 66.43 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 120.424 -1.422 . . . . 0.0 108.842 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -49.55 68.85 Favored 'General case' 0 C--N 1.389 2.304 0 C-N-CA 125.797 1.639 . . . . 0.0 112.979 164.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 129' ' ' LEU . . . -69.63 -45.99 67.22 Favored 'General case' 0 C--N 1.36 1.042 0 C-N-CA 127.527 2.331 . . . . 0.0 116.735 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 73' ' ' ASN . 34.5 tttm -75.93 -22.84 55.58 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 128.495 2.718 . . . . 0.0 118.058 -179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.0 -22.24 64.32 Favored 'General case' 0 C--N 1.376 1.725 0 C-N-CA 131.439 3.896 . . . . 0.0 113.501 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB3' ' HG3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -54.98 -42.53 72.56 Favored 'General case' 0 N--CA 1.446 -0.633 1 C-N-CA 134.304 5.042 . . . . 0.0 114.465 -179.077 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.6 t -110.95 0.06 16.92 Favored 'General case' 0 C--N 1.365 1.243 0 O-C-N 120.352 -1.467 . . . . 0.0 114.33 173.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.4 m170 66.46 59.6 0.62 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.936 2.494 . . . . 0.0 114.774 -169.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.568 ' ND2' ' H ' ' A' ' 134' ' ' LYS 0.349 49.1 t-20 -86.27 150.24 51.49 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 128.776 2.83 . . . . 0.0 108.842 -177.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.42 60.54 7.56 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 CA-C-N 127.104 3.573 . . . . 0.0 113.041 -171.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -78.78 20.21 0.47 Allowed 'General case' 0 C--N 1.376 1.72 0 C-N-CA 127.42 2.288 . . . . 0.0 112.11 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 24.5 mt -128.23 147.58 32.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.716 0 C-N-CA 130.239 3.416 . . . . 0.0 104.901 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -113.41 167.39 10.62 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.747 1.619 . . . . 0.0 108.925 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -55.76 -8.53 0.42 Allowed 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -103.54 -5.56 22.62 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 127.86 2.464 . . . . 0.0 109.996 177.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.55 29.06 58.45 Favored Glycine 0 C--N 1.364 2.135 0 C-N-CA 129.568 3.461 . . . . 0.0 114.23 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -97.95 166.27 11.52 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 127.348 2.259 . . . . 0.0 106.64 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.74 145.18 31.66 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 128.427 2.691 . . . . 0.0 113.475 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.13 158.39 32.41 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -172.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 22.1 mm -136.17 112.73 10.35 Favored Pre-proline 0 C--N 1.37 1.491 0 C-N-CA 126.331 1.853 . . . . 0.0 112.452 -174.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -78.74 -178.81 4.92 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 124.909 3.739 . . . . 0.0 112.803 164.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -60.89 -50.27 74.09 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 129.804 3.242 . . . . 0.0 118.678 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.56 -35.97 82.33 Favored Glycine 0 N--CA 1.496 2.69 0 C-N-CA 126.444 1.973 . . . . 0.0 113.014 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.33 11.9 t -72.18 -22.76 21.14 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 128.11 2.564 . . . . 0.0 113.833 171.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.429 ' HA ' HG22 ' A' ' 92' ' ' VAL . 0.8 OUTLIER -70.45 -43.47 69.8 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 119.312 -2.118 . . . . 0.0 111.193 170.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.482 20.6 tt -65.18 -27.06 41.21 Favored 'Isoleucine or valine' 0 C--N 1.376 1.746 0 O-C-N 121.113 -0.992 . . . . 0.0 113.43 170.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -68.4 -54.19 18.82 Favored 'General case' 0 C--N 1.371 1.539 0 CA-C-O 117.201 -1.381 . . . . 0.0 112.698 167.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.506 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.348 27.6 m -56.0 -59.43 2.76 Favored 'Isoleucine or valine' 0 C--N 1.369 1.427 0 CA-C-N 122.324 2.329 . . . . 0.0 116.157 -178.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 97' ' ' GLN . . . -55.63 -57.57 11.43 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 127.827 2.451 . . . . 0.0 114.265 171.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.392 4.7 mtmp? -75.89 -31.91 59.43 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 122.557 2.435 . . . . 0.0 117.403 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.19 -51.59 69.32 Favored 'General case' 0 CA--C 1.473 -2.016 0 C-N-CA 128.252 2.621 . . . . 0.0 113.02 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 99' ' ' TYR 0.324 . . -76.32 -28.82 57.06 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-N 113.891 -1.504 . . . . 0.0 110.191 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 32.8 tt0 -57.41 -35.1 69.62 Favored 'General case' 0 C--N 1.361 1.08 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 170.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -72.92 -56.34 5.31 Favored 'General case' 0 C--N 1.366 1.295 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 173.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 96' ' ' ALA 0.56 0.5 OUTLIER -72.01 -38.73 69.56 Favored 'General case' 0 C--N 1.377 1.784 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 179.459 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 41.4 tpp -61.06 -28.25 68.93 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 128.623 2.769 . . . . 0.0 112.606 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.8 m -56.64 -17.67 9.52 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 128.998 2.919 . . . . 0.0 113.839 170.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -98.96 -0.7 41.61 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.829 2.051 . . . . 0.0 111.263 170.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.583 ' HB1' ' HA3' ' A' ' 107' ' ' GLY . . . -104.76 23.49 13.35 Favored 'General case' 0 C--N 1.357 0.93 0 N-CA-C 120.923 3.675 . . . . 0.0 120.923 -167.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -81.05 -8.48 87.35 Favored Glycine 0 C--N 1.352 1.444 0 O-C-N 118.497 -2.627 . . . . 0.0 112.204 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.48 HD23 ' H ' ' A' ' 105' ' ' LEU . 2.3 pt? -118.82 -60.9 1.71 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 128.664 2.786 . . . . 0.0 116.446 -178.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.1 t -87.58 -10.21 52.17 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 125.187 1.395 . . . . 0.0 111.18 -173.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.583 ' HA3' ' HB1' ' A' ' 103' ' ' ALA . . . -78.4 17.8 6.12 Favored Glycine 0 C--N 1.354 1.582 0 C-N-CA 128.874 3.131 . . . . 0.0 117.343 -169.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -157.82 8.53 0.16 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.642 2.777 . . . . 0.0 110.352 -170.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.5 m -97.22 71.74 2.41 Favored 'General case' 0 C--N 1.367 1.359 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 174.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.0 mtt -50.62 -49.14 57.5 Favored 'General case' 0 C--N 1.366 1.286 0 C-N-CA 129.723 3.209 . . . . 0.0 118.912 -168.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.7 t70 66.63 -78.88 0.04 OUTLIER 'General case' 0 C--N 1.37 1.491 0 C-N-CA 126.942 2.097 . . . . 0.0 114.274 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 43.2 p -98.93 -41.86 7.4 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.65 1.98 . . . . 0.0 110.436 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.479 0.3 OUTLIER 103.99 -18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.043 0 C-N-CA 130.72 3.608 . . . . 0.0 111.419 -176.23 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.5 t -95.99 9.48 40.59 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.817 1.647 . . . . 0.0 110.624 171.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 43.7 -93.97 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 130.379 3.472 . . . . 0.0 118.616 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 4.06 0.12 Allowed 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.721 2.009 . . . . 0.0 114.178 -165.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . 0.48 68.8 m-85 -41.76 -5.81 0.0 OUTLIER 'General case' 0 C--N 1.367 1.326 1 N-CA-C 124.094 4.85 . . . . 0.0 124.094 -162.397 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -89.51 -28.68 19.48 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 126.306 1.843 . . . . 0.0 113.793 169.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.1 t -133.5 11.14 4.09 Favored 'General case' 0 C--N 1.365 1.28 0 N-CA-C 118.202 2.668 . . . . 0.0 118.202 -163.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -102.84 -18.98 14.86 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -93.55 163.7 23.57 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 128.458 2.703 . . . . 0.0 114.93 -169.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -70.15 133.99 26.12 Favored 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 124.746 3.63 . . . . 0.0 117.218 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 4.1 t -68.71 -12.51 61.51 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.12 2.168 . . . . 0.0 115.665 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.1 t -85.47 -44.3 12.84 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.973 2.509 . . . . 0.0 112.767 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.397 1.0 OUTLIER -71.4 -26.67 27.02 Favored 'Isoleucine or valine' 0 C--N 1.372 1.575 0 C-N-CA 128.379 2.672 . . . . 0.0 111.593 173.831 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 129' ' ' LEU 0.369 3.6 tp -50.8 -24.6 3.61 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.458 3.503 . . . . 0.0 116.668 173.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -80.08 -21.93 42.81 Favored 'General case' 0 C--N 1.361 1.106 0 O-C-N 119.402 -2.061 . . . . 0.0 112.103 168.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -78.87 -14.69 59.1 Favored 'General case' 0 C--N 1.365 1.261 0 C-N-CA 128.143 2.577 . . . . 0.0 112.511 173.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 67' ' ' ALA . 4.9 tt -60.49 -24.07 65.01 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.884 2.873 . . . . 0.0 113.848 164.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -95.12 -29.51 0.27 Allowed Pre-proline 0 CA--C 1.552 1.039 1 N-CA-C 123.741 4.719 . . . . 0.0 123.741 -172.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -59.25 -7.39 5.0 Favored 'Trans proline' 0 N--CA 1.487 1.134 3 CA-C-N 130.457 4.77 . . . . 0.0 123.364 -162.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.29 -136.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 129.646 3.178 . . . . 0.0 117.975 -176.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -98.18 -41.11 8.05 Favored 'General case' 0 C--N 1.368 1.385 0 O-C-N 119.328 -2.107 . . . . 0.0 114.259 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.568 ' H ' ' ND2' ' A' ' 73' ' ' ASN 0.436 0.0 OUTLIER -40.86 -41.37 1.58 Allowed 'General case' 0 C--N 1.376 1.735 0 N-CA-C 120.047 3.351 . . . . 0.0 120.047 -174.406 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -15.94 61.3 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 175.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -100.85 5.62 43.47 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 126.694 1.998 . . . . 0.0 114.662 -174.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 . . . . . 0 C--N 1.364 1.214 0 C-N-CA 128.636 2.774 . . . . 0.0 115.31 176.56 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.5 ptt85 -90.01 -12.47 38.5 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.921 2.088 . . . . 0.0 113.927 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.7 t -70.5 -45.26 75.44 Favored 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 127.096 2.158 . . . . 0.0 114.295 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.272 8.1 ptpp? -68.12 -26.39 65.77 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.664 1.986 . . . . 0.0 113.437 173.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -60.47 -26.19 66.6 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.69 -25.18 58.98 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 130.36 3.464 . . . . 0.0 113.498 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.79 -19.28 5.79 Favored 'General case' 0 C--N 1.35 0.591 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.9 p -81.42 -12.62 58.88 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 121.804 2.093 . . . . 0.0 112.19 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 -66.24 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.617 0 CA-C-N 113.912 -1.495 . . . . 0.0 110.767 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.3 m -93.53 77.21 4.39 Favored 'General case' 0 C--N 1.356 0.877 0 O-C-N 119.726 -1.859 . . . . 0.0 111.67 -177.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 164.33 -61.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 102.285 -3.228 . . . . 0.0 102.285 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.66 171.52 1.53 Allowed 'General case' 0 C--N 1.379 1.859 0 C-N-CA 125.19 1.396 . . . . 0.0 113.497 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -53.56 -27.2 24.84 Favored 'General case' 0 C--N 1.362 1.146 0 O-C-N 118.715 -2.49 . . . . 0.0 117.699 -172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -7.9 15.51 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 130.351 3.46 . . . . 0.0 113.988 176.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -66.05 -35.42 80.5 Favored 'General case' 0 C--N 1.374 1.663 0 C-N-CA 130.015 3.326 . . . . 0.0 111.104 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -71.98 -39.43 69.31 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 125.853 1.661 . . . . 0.0 112.73 174.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -74.55 -44.8 49.28 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.634 2.374 . . . . 0.0 112.118 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 93' ' ' ALA 0.261 0.2 OUTLIER -61.49 -50.94 70.72 Favored 'General case' 0 C--N 1.386 2.159 0 C-N-CA 125.204 1.402 . . . . 0.0 110.027 171.75 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.525 HG22 HG23 ' A' ' 92' ' ' VAL 0.59 77.3 p -58.47 -48.53 80.45 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 112.216 -3.754 . . . . 0.0 118.298 166.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HA ' ' HD2' ' A' ' 61' ' ' PRO 0.495 0.6 OUTLIER -60.52 -27.8 67.9 Favored 'General case' 0 N--CA 1.503 2.209 1 CA-C-N 128.239 5.018 . . . . 0.0 120.859 176.317 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.2 mtp -54.68 -37.76 66.16 Favored 'General case' 0 C--N 1.387 2.236 0 CA-C-O 125.146 2.403 . . . . 0.0 111.246 169.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.517 1.7 t -71.13 -55.58 6.23 Favored Pre-proline 0 C--O 1.21 -1.014 1 CA-C-O 110.286 -4.674 . . . . 0.0 115.598 174.545 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' ' HA ' ' A' ' 58' ' ' GLU . 22.4 Cg_exo -50.97 -19.6 5.86 Favored 'Trans proline' 0 C--N 1.372 1.77 2 CA-C-N 135.635 6.62 . . . . 0.0 115.595 167.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -57.53 12.65 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 120.633 1.561 . . . . 0.0 113.248 157.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 117' ' ' PHE 0.338 0.5 OUTLIER -75.51 -45.89 35.51 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 121.197 3.776 . . . . 0.0 121.197 171.213 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.31 18.6 m -65.81 -29.57 47.35 Favored 'Isoleucine or valine' 0 C--N 1.378 1.814 1 O-C-N 116.263 -4.023 . . . . 0.0 113.426 174.85 . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.475 78.1 mt-10 -77.51 -40.08 44.06 Favored 'General case' 0 C--N 1.374 1.667 0 O-C-N 120.476 -1.39 . . . . 0.0 109.723 175.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -55.12 39.24 Favored 'General case' 0 C--N 1.387 2.202 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.7 -41.81 68.17 Favored 'General case' 0 C--N 1.355 0.835 1 C-N-CA 132.476 4.31 . . . . 0.0 117.094 178.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.513 0.0 OUTLIER -75.67 -22.68 56.49 Favored 'General case' 0 C--N 1.374 1.639 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 176.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -65.31 -24.02 67.17 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 119.637 -1.915 . . . . 0.0 114.198 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -75.52 -20.08 58.94 Favored 'General case' 0 N--CA 1.444 -0.77 1 C-N-CA 134.146 4.979 . . . . 0.0 115.628 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.7 p -65.2 -27.95 69.04 Favored 'General case' 0 C--N 1.371 1.534 0 N-CA-C 119.894 3.294 . . . . 0.0 119.894 -166.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 153.82 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.356 0.859 0 C-N-CA 129.225 3.01 . . . . 0.0 105.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.75 151.71 61.02 Favored Pre-proline 0 C--N 1.358 0.976 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -81.79 4.75 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.548 2.832 . . . . 0.0 112.922 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.489 ' HD1' ' H ' ' A' ' 83' ' ' SER 0.391 4.6 p90 66.21 4.42 3.14 Favored 'General case' 0 C--N 1.377 1.776 1 C-N-CA 133.153 4.581 . . . . 0.0 114.933 -178.165 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 96.1 mt -81.08 150.08 4.76 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 129.646 3.178 . . . . 0.0 108.88 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -114.86 171.35 7.7 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.436 1.495 . . . . 0.0 110.337 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.42 -15.7 0.45 Allowed 'General case' 0 C--N 1.369 1.433 0 C-N-CA 130.094 3.357 . . . . 0.0 119.679 -178.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -99.24 -10.4 22.45 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 126.483 1.913 . . . . 0.0 110.094 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.52 33.28 31.68 Favored Glycine 0 C--N 1.362 2.015 0 C-N-CA 129.679 3.514 . . . . 0.0 114.225 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -96.62 142.25 28.9 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.544 1.938 . . . . 0.0 108.608 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 153.71 32.31 Favored 'General case' 0 C--N 1.355 0.81 1 C-N-CA 132.374 4.27 . . . . 0.0 113.639 -178.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.489 ' H ' ' HD1' ' A' ' 75' ' ' PHE . 3.7 t -148.56 158.31 44.04 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 2.1 mp -141.41 112.86 6.62 Favored Pre-proline 0 C--N 1.379 1.85 0 C-N-CA 130.692 3.597 . . . . 0.0 107.84 -176.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.08 175.05 11.33 Favored 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 125.279 3.986 . . . . 0.0 113.2 170.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -56.21 -37.31 69.49 Favored 'General case' 0 C--N 1.363 1.16 0 C-N-CA 129.988 3.315 . . . . 0.0 119.513 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.02 -41.77 39.15 Favored Glycine 0 N--CA 1.495 2.593 0 O-C-N 119.999 -1.688 . . . . 0.0 113.126 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.558 ' O ' HG13 ' A' ' 92' ' ' VAL 0.529 0.5 OUTLIER -69.84 -23.02 25.24 Favored 'Isoleucine or valine' 0 C--N 1.371 1.541 0 O-C-N 119.838 -1.978 . . . . 0.0 113.1 177.305 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.6 tp -70.15 -42.76 72.12 Favored 'General case' 0 C--N 1.37 1.494 1 C-N-CA 132.277 4.231 . . . . 0.0 113.138 172.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.257 10.5 pt -62.97 -33.79 62.65 Favored 'Isoleucine or valine' 0 C--N 1.39 2.361 0 O-C-N 121.003 -1.061 . . . . 0.0 111.647 169.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -65.99 -45.54 81.22 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 126.035 1.734 . . . . 0.0 111.144 171.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.683 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.442 2.8 m -54.48 -62.47 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.38 1.909 0 CA-C-N 122.455 2.389 . . . . 0.0 114.554 177.449 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.487 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.07 -52.42 43.59 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 169.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -75.32 -31.05 60.5 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 121.698 2.044 . . . . 0.0 116.09 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.42 -56.45 21.83 Favored 'General case' 0 C--N 1.377 1.799 0 C-N-CA 129.824 3.25 . . . . 0.0 112.815 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.14 -29.76 54.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 112.625 -2.079 . . . . 0.0 112.34 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' ALA . 22.4 tt0 -59.41 -37.32 77.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.129 1.529 . . . . 0.0 115.129 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -72.99 -55.61 6.29 Favored 'General case' 0 C--N 1.354 0.775 0 C-N-CA 124.952 1.301 . . . . 0.0 112.388 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.427 ' CD2' HG22 ' A' ' 121' ' ' ILE . 8.8 t80 -71.41 -53.48 13.91 Favored 'General case' 0 C--N 1.361 1.109 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.3 ttp -55.33 -27.17 45.35 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 130.053 3.341 . . . . 0.0 115.603 -174.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.1 m -70.3 -13.27 62.09 Favored 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 136.574 5.95 . . . . 0.0 112.987 179.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -73.19 14.16 0.34 Allowed 'General case' 0 C--N 1.373 1.612 0 O-C-N 118.108 -2.87 . . . . 0.0 115.56 176.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -36.99 -34.61 0.08 Allowed 'General case' 0 C--N 1.366 1.292 1 C-N-CA 132.953 4.501 . . . . 0.0 120.633 -171.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.68 42.16 0.09 OUTLIER Glycine 0 CA--C 1.481 -2.089 0 N-CA-C 107.847 -2.101 . . . . 0.0 107.847 165.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 106' ' ' THR . 0.2 OUTLIER -118.07 -77.44 0.57 Allowed 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 122.886 1.327 . . . . 0.0 108.654 -177.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.485 ' H ' HD12 ' A' ' 105' ' ' LEU . 97.9 m -79.37 -35.26 41.11 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 129.153 2.981 . . . . 0.0 111.452 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.74 82.59 0.5 Allowed Glycine 0 C--N 1.361 1.955 0 C-N-CA 128.905 3.145 . . . . 0.0 115.898 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -55.09 83.82 0.0 OUTLIER 'General case' 0 C--N 1.372 1.556 0 C-N-CA 128.322 2.649 . . . . 0.0 115.642 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.6 t 74.6 28.09 1.27 Allowed 'General case' 0 C--N 1.368 1.399 0 C-N-CA 129.679 3.191 . . . . 0.0 111.22 -173.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.345 10.8 ttt 51.56 35.38 14.48 Favored 'General case' 0 C--N 1.371 1.519 1 C-N-CA 132.194 4.198 . . . . 0.0 116.647 -176.602 . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 69.16 16.79 8.52 Favored 'General case' 0 C--N 1.365 1.255 0 C-N-CA 129.194 2.997 . . . . 0.0 113.801 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.352 0.7 OUTLIER 112.41 -31.07 0.01 OUTLIER 'General case' 0 C--N 1.361 1.066 0 C-N-CA 131.683 3.993 . . . . 0.0 110.153 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . 0.43 0.4 OUTLIER 88.48 146.73 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.36 0 C-N-CA 126.662 1.985 . . . . 0.0 111.847 -178.279 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 16.0 t 72.16 28.08 2.51 Favored 'General case' 0 C--N 1.372 1.579 0 C-N-CA 125.494 1.517 . . . . 0.0 110.054 -168.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -52.2 172.2 0.04 OUTLIER 'General case' 0 C--N 1.366 1.323 1 C-N-CA 134.776 5.23 . . . . 0.0 120.666 -174.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.12 130.98 14.19 Favored 'General case' 0 C--N 1.365 1.246 0 O-C-N 119.72 -1.862 . . . . 0.0 114.708 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.56 ' HB3' HD22 ' A' ' 63' ' ' LEU . 0.7 OUTLIER -76.87 -10.35 59.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.297 3.439 . . . . 0.0 115.922 -176.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.54 -8.45 57.53 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 127.28 2.232 . . . . 0.0 109.887 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . 0.268 8.8 t -122.29 -36.92 2.88 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 125.609 1.564 . . . . 0.0 111.161 172.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -99.54 -133.62 0.26 Allowed 'General case' 0 C--N 1.372 1.56 0 CA-C-N 120.906 1.684 . . . . 0.0 113.763 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.479 ' HB ' ' HD2' ' A' ' 122' ' ' PRO 0.348 38.7 pt 65.72 162.27 0.13 Allowed Pre-proline 0 N--CA 1.5 2.036 1 C-N-CA 132.287 4.235 . . . . 0.0 120.462 179.7 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.479 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 43.1 Cg_endo -60.6 120.3 7.96 Favored 'Trans proline' 0 C--N 1.393 2.909 0 C-N-CA 124.676 3.584 . . . . 0.0 114.727 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.0 t -70.92 -9.79 58.44 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.269 2.227 . . . . 0.0 113.781 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -85.42 -42.95 14.05 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 128.232 2.613 . . . . 0.0 113.404 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.269 1.8 mm -71.93 -28.88 31.33 Favored 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-O 124.431 2.062 . . . . 0.0 110.988 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.46 -26.7 13.55 Favored 'General case' 0 C--N 1.372 1.552 0 C-N-CA 130.065 3.346 . . . . 0.0 115.624 178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -83.44 -19.78 35.3 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.314 1.846 . . . . 0.0 112.098 172.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -78.04 -16.47 58.03 Favored 'General case' 0 C--N 1.377 1.766 0 C-N-CA 127.411 2.284 . . . . 0.0 112.439 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -56.55 -43.07 79.57 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 127.723 2.409 . . . . 0.0 113.597 169.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.78 -31.44 0.53 Allowed Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 119.203 3.038 . . . . 0.0 119.203 -175.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.04 -8.53 16.41 Favored 'Trans proline' 0 CA--C 1.548 1.179 1 CA-C-N 129.817 4.542 . . . . 0.0 116.129 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -19.87 -128.97 0.0 OUTLIER 'General case' 0 C--N 1.373 1.601 1 C-N-CA 134.352 5.061 . . . . 0.0 120.891 176.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.67 -24.01 18.03 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 119.503 -1.998 . . . . 0.0 115.213 176.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -29.39 67.9 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -171.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 19.6 ptp -107.94 23.4 14.54 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 125.56 1.544 . . . . 0.0 112.214 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -72.79 60.86 0.52 Allowed 'General case' 0 C--N 1.361 1.085 0 C-N-CA 127.248 2.219 . . . . 0.0 115.67 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 . . . . . 0 C--N 1.359 1.015 0 C-N-CA 129.572 3.149 . . . . 0.0 113.316 179.417 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 . . . . . 0 N--CA 1.443 -0.825 0 CA-C-O 121.339 0.59 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -104.93 123.08 47.13 Favored 'General case' 0 C--N 1.348 0.53 0 C-N-CA 126.43 1.892 . . . . 0.0 107.6 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.85 -35.85 72.92 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 127.55 2.34 . . . . 0.0 116.081 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -68.4 -26.76 65.71 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 128.629 2.772 . . . . 0.0 112.816 172.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -58.55 -25.12 62.15 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 127.297 2.239 . . . . 0.0 116.941 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mp -74.6 -36.25 62.97 Favored 'General case' 0 C--N 1.364 1.219 0 C-N-CA 127.447 2.299 . . . . 0.0 112.576 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -108.73 -19.06 13.55 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 116.361 1.985 . . . . 0.0 116.361 178.437 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 m -78.04 -17.07 57.5 Favored 'General case' 0 C--N 1.375 1.702 0 C-N-CA 126.277 1.831 . . . . 0.0 113.912 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.267 0.6 OUTLIER -121.7 -68.92 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.663 0 C-N-CA 125.824 1.65 . . . . 0.0 111.136 -179.209 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.2 t -94.76 80.62 3.76 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 119.606 -1.934 . . . . 0.0 111.272 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 20.0 m-80 163.77 -62.05 0.0 OUTLIER 'General case' 0 C--N 1.353 0.719 0 C-N-CA 130.016 3.326 . . . . 0.0 102.569 -177.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -61.15 179.13 0.21 Allowed 'General case' 0 C--N 1.381 1.968 0 C-N-CA 125.792 1.637 . . . . 0.0 114.522 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -67.32 -21.47 65.66 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 118.34 -2.725 . . . . 0.0 115.079 -169.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -63.08 -10.64 15.26 Favored 'General case' 0 N--CA 1.438 -1.071 0 C-N-CA 130.627 3.571 . . . . 0.0 115.085 174.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -67.23 -31.38 71.7 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 128.076 2.55 . . . . 0.0 111.229 173.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -71.98 -41.96 67.05 Favored 'General case' 0 C--N 1.37 1.471 0 C-N-CA 125.97 1.708 . . . . 0.0 112.221 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -72.47 -46.36 55.25 Favored 'General case' 0 C--N 1.362 1.112 0 C-N-CA 127.448 2.299 . . . . 0.0 112.741 177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.63 HD23 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -62.46 -51.66 66.62 Favored 'General case' 0 C--N 1.378 1.835 0 O-C-N 121.153 -0.967 . . . . 0.0 112.36 173.707 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.63 HG23 HD23 ' A' ' 56' ' ' LEU 0.614 63.2 p -60.2 -32.87 71.5 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 114.156 -2.83 . . . . 0.0 117.464 167.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.64 -44.08 87.52 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 125.935 3.971 . . . . 0.0 117.431 172.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.0 mtp -45.29 -47.85 13.02 Favored 'General case' 0 C--N 1.383 2.03 0 C-N-CA 128.555 2.742 . . . . 0.0 114.442 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.574 HG13 HD23 ' A' ' 63' ' ' LEU 0.407 0.3 OUTLIER -70.6 -54.34 8.53 Favored Pre-proline 0 C--O 1.204 -1.308 1 CA-C-O 110.494 -4.574 . . . . 0.0 115.198 -179.682 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -54.96 -16.34 11.75 Favored 'Trans proline' 0 C--N 1.363 1.32 2 CA-C-N 134.589 6.246 . . . . 0.0 115.51 167.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.95 -43.29 93.2 Favored 'General case' 0 CA--C 1.576 1.947 0 CA-C-N 121.955 2.161 . . . . 0.0 112.444 158.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.688 HD22 HD12 ' A' ' 121' ' ' ILE . 30.5 tp -68.73 -54.14 17.87 Favored 'General case' 0 C--N 1.368 1.379 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 169.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' LYS 0.457 1.4 p -69.41 -39.33 78.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 O-C-N 117.428 -3.295 . . . . 0.0 113.724 177.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.414 28.6 mt-10 -75.63 -36.3 60.24 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 122.859 2.572 . . . . 0.0 112.398 177.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . 0.289 0.0 OUTLIER -66.05 -47.53 74.05 Favored 'General case' 0 C--N 1.391 2.405 0 O-C-N 119.555 -1.965 . . . . 0.0 114.876 170.29 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.93 -36.66 72.73 Favored 'General case' 0 C--N 1.358 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 114.326 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 64' ' ' VAL 0.375 0.2 OUTLIER -74.72 -21.05 59.59 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 126.951 2.1 . . . . 0.0 114.109 176.415 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.448 ' HA ' ' CE2' ' A' ' 75' ' ' PHE 0.33 20.1 p30 -52.25 -23.28 5.44 Favored 'General case' 0 C--N 1.387 2.233 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 177.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.68 -11.57 60.21 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.851 3.26 . . . . 0.0 115.656 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 72.4 m -94.48 21.47 7.15 Favored 'General case' 0 C--N 1.369 1.436 0 N-CA-C 115.937 1.828 . . . . 0.0 115.937 -168.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 48.5 m80 85.48 -33.07 0.05 OUTLIER 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.356 2.662 . . . . 0.0 115.67 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.451 HD21 ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -93.78 159.5 34.52 Favored Pre-proline 0 C--N 1.35 0.592 0 C-N-CA 124.961 1.304 . . . . 0.0 112.774 -172.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -88.86 -12.29 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.685 2.256 . . . . 0.0 113.266 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' ASP 0.395 2.5 p90 38.51 30.59 0.03 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 130.059 3.344 . . . . 0.0 118.509 -175.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 79.7 mt -132.38 141.56 44.92 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 N-CA-C 102.516 -3.142 . . . . 0.0 102.516 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -114.91 168.84 9.55 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 124.566 1.146 . . . . 0.0 110.481 -174.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -42.43 -22.77 0.03 OUTLIER 'General case' 0 C--N 1.364 1.218 0 N-CA-C 121.645 3.942 . . . . 0.0 121.645 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -102.5 -7.1 22.18 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 126.937 2.095 . . . . 0.0 110.55 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.95 28.7 40.8 Favored Glycine 0 C--N 1.36 1.889 0 C-N-CA 129.263 3.316 . . . . 0.0 114.153 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -89.34 148.67 23.4 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 127.424 2.289 . . . . 0.0 107.503 176.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.25 143.33 43.12 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 129.654 3.182 . . . . 0.0 114.743 -177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -105.36 95.82 6.09 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 119.678 -1.889 . . . . 0.0 107.753 -178.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.0 mm -118.82 100.69 50.85 Favored Pre-proline 0 C--N 1.357 0.922 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -172.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.25 171.66 15.59 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.164 3.243 . . . . 0.0 113.288 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.6 m -48.07 -47.02 34.23 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -173.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.1 -42.22 44.64 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 120.778 -1.201 . . . . 0.0 114.861 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER -68.64 -25.68 31.35 Favored 'Isoleucine or valine' 0 C--N 1.374 1.662 0 O-C-N 120.667 -1.49 . . . . 0.0 112.362 178.287 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -70.13 -45.38 66.97 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 130.632 3.573 . . . . 0.0 113.261 172.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.259 0.5 OUTLIER -65.28 -30.34 49.98 Favored 'Isoleucine or valine' 0 C--N 1.384 2.1 0 O-C-N 120.307 -1.496 . . . . 0.0 112.256 175.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE2' ' HA ' ' A' ' 129' ' ' LEU . 5.5 t80 -66.26 -47.36 73.96 Favored 'General case' 0 C--N 1.37 1.494 0 C-N-CA 128.307 2.643 . . . . 0.0 110.24 169.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.553 HG23 HG22 ' A' ' 57' ' ' THR 0.405 8.5 m -55.81 -60.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 CA-C-N 123.338 2.79 . . . . 0.0 114.95 176.457 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 56' ' ' LEU . . . -51.39 -47.46 62.89 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 127.671 2.389 . . . . 0.0 116.501 169.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HA ' ' HG2' ' A' ' 97' ' ' GLN 0.493 15.2 ptpt -75.2 -37.42 61.17 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.27 . . -57.33 -52.2 66.31 Favored 'General case' 0 C--N 1.371 1.51 0 C-N-CA 128.83 2.852 . . . . 0.0 114.4 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . 0.28 . . -78.35 -29.88 47.75 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 112.113 -2.312 . . . . 0.0 114.197 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.514 ' HG2' ' HA ' ' A' ' 94' ' ' LYS 0.283 8.7 pt20 -64.58 -27.16 68.76 Favored 'General case' 0 C--N 1.383 2.05 0 CA-C-N 122.295 2.316 . . . . 0.0 115.029 170.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CD2' ' HG3' ' A' ' 122' ' ' PRO . 66.5 m-85 -74.35 -56.66 4.61 Favored 'General case' 0 C--N 1.371 1.541 0 CA-C-N 120.598 1.544 . . . . 0.0 114.991 164.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 120' ' ' GLU 0.273 3.5 t80 -72.35 -37.64 68.77 Favored 'General case' 0 C--N 1.363 1.169 0 N-CA-C 121.409 3.855 . . . . 0.0 121.409 -170.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . 0.331 0.1 OUTLIER -67.23 -25.84 66.3 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 127.385 2.274 . . . . 0.0 115.494 -176.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.3 p -50.16 -24.39 2.76 Favored 'General case' 0 C--N 1.366 1.298 1 C-N-CA 133.301 4.64 . . . . 0.0 114.885 -175.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . 0.349 0.5 OUTLIER 96.13 65.66 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 129.133 2.973 . . . . 0.0 110.61 173.294 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.18 22.43 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.61 27.13 55.2 Favored Glycine 0 C--N 1.366 2.203 0 C-N-CA 127.797 2.618 . . . . 0.0 116.634 174.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.4 pp -117.3 -36.92 3.63 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 126.664 1.986 . . . . 0.0 114.077 -175.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.4 t -117.69 25.07 10.66 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 127.713 2.405 . . . . 0.0 106.956 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -87.2 9.29 73.4 Favored Glycine 0 C--N 1.363 2.067 0 C-N-CA 127.403 2.43 . . . . 0.0 118.441 -165.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -104.91 30.22 5.69 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 125.739 1.616 . . . . 0.0 111.373 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . 0.325 86.8 p 73.65 16.22 3.92 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 127.303 2.241 . . . . 0.0 116.219 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.4 mtp -63.11 51.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 131.383 3.873 . . . . 0.0 117.819 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -79.17 61.18 3.23 Favored 'General case' 0 C--N 1.357 0.914 0 O-C-N 119.317 -2.114 . . . . 0.0 113.168 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.391 22.1 p 125.4 122.01 0.0 OUTLIER 'General case' 0 C--N 1.356 0.848 1 C-N-CA 132.97 4.508 . . . . 0.0 107.803 -178.365 . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.432 HG22 ' H ' ' A' ' 114' ' ' SER . 9.8 p -164.68 -178.18 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 100.334 -3.95 . . . . 0.0 100.334 -177.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.432 ' H ' HG22 ' A' ' 113' ' ' VAL . 6.7 m -72.33 53.85 0.3 Allowed 'General case' 0 C--N 1.364 1.205 0 C-N-CA 127.892 2.477 . . . . 0.0 112.25 174.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -33.48 123.95 0.42 Allowed 'General case' 0 C--N 1.36 1.026 2 C-N-CA 135.794 5.638 . . . . 0.0 121.894 -170.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.98 23.26 0.01 OUTLIER 'General case' 0 C--N 1.356 0.858 0 N-CA-C 121.232 3.79 . . . . 0.0 121.232 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 120' ' ' GLU . 41.5 m-85 -68.53 -1.45 6.7 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 127.656 2.382 . . . . 0.0 116.602 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.69 -30.6 19.01 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 130.494 3.518 . . . . 0.0 112.174 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 t -136.62 2.2 2.65 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -172.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 99' ' ' TYR 0.288 4.7 pt-20 -67.3 -100.17 0.0 OUTLIER 'General case' 0 C--N 1.37 1.491 0 N-CA-C 121.233 3.79 . . . . 0.0 121.233 -173.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.688 HD12 HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -16.42 152.33 0.0 OUTLIER Pre-proline 0 C--N 1.367 1.359 1 C-N-CA 135.974 5.709 . . . . 0.0 121.212 -178.209 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.452 ' HG3' ' CD2' ' A' ' 98' ' ' PHE . 36.6 Cg_endo -58.92 117.46 4.2 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 124.906 3.737 . . . . 0.0 113.16 -178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 2.6 m -33.38 -29.54 0.01 OUTLIER 'General case' 0 C--N 1.366 1.302 1 C-N-CA 133.095 4.558 . . . . 0.0 120.7 -171.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.35 -42.95 58.53 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.826 2.451 . . . . 0.0 113.385 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.366 0.0 OUTLIER -70.95 -28.3 33.01 Favored 'Isoleucine or valine' 0 C--N 1.384 2.067 0 O-C-N 119.72 -1.863 . . . . 0.0 113.521 176.838 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . 0.266 37.5 tp -61.92 -26.61 68.28 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 128.193 2.597 . . . . 0.0 113.799 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -77.35 -30.15 53.75 Favored 'General case' 0 C--N 1.364 1.23 0 C-N-CA 126.08 1.752 . . . . 0.0 111.254 168.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.298 13.2 tttt -70.24 -13.49 62.2 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 130.675 3.59 . . . . 0.0 113.889 173.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.435 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 2.1 tm? -57.02 -35.94 69.86 Favored 'General case' 0 C--N 1.379 1.857 0 C-N-CA 127.896 2.478 . . . . 0.0 111.037 164.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -86.93 -32.14 0.43 Allowed Pre-proline 0 C--N 1.363 1.155 0 N-CA-C 120.739 3.607 . . . . 0.0 120.739 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -61.65 -8.01 10.25 Favored 'Trans proline' 0 CA--C 1.55 1.312 2 CA-C-N 131.383 5.101 . . . . 0.0 115.677 170.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.413 ' CD2' ' HG3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -24.05 -121.91 0.0 OUTLIER 'General case' 0 C--N 1.364 1.236 2 C-N-CA 134.77 5.228 . . . . 0.0 122.495 175.483 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -94.04 -51.42 4.86 Favored 'General case' 0 C--N 1.348 0.533 0 C-N-CA 126.899 2.08 . . . . 0.0 114.497 177.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 39.39 0.73 Allowed 'General case' 0 C--N 1.37 1.487 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -174.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.3 mmt -132.02 -0.47 3.77 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 129.319 3.047 . . . . 0.0 107.427 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -140.93 151.97 44.65 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 125.059 1.344 . . . . 0.0 109.115 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 C--N 1.368 1.377 0 C-N-CA 125.463 1.505 . . . . 0.0 111.636 -179.717 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.6 mmt-85 -98.67 89.79 4.49 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.389 1.876 . . . . 0.0 106.77 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.409 HG23 ' H ' ' A' ' 41' ' ' VAL . 4.8 t -53.94 -35.81 29.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.284 0 C-N-CA 129.243 3.017 . . . . 0.0 115.628 -174.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -68.42 -27.61 66.35 Favored 'General case' 0 C--N 1.367 1.334 0 C-N-CA 127.237 2.215 . . . . 0.0 113.827 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -65.91 -26.05 67.43 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 125.278 1.431 . . . . 0.0 114.14 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.59 -28.26 68.37 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 127.831 2.452 . . . . 0.0 113.939 175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 49' ' ' ASN . 0.6 OUTLIER -124.91 -18.74 5.44 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 118.259 2.688 . . . . 0.0 118.259 176.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.9 t -77.05 -19.82 56.66 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.687 1.995 . . . . 0.0 111.48 178.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . 0.263 0.1 OUTLIER -127.94 -55.63 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.078 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.802 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 m -91.38 68.23 5.8 Favored 'General case' 0 C--N 1.369 1.445 0 O-C-N 120.328 -1.483 . . . . 0.0 112.159 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 45' ' ' LEU . 28.4 m-80 169.43 -66.94 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 102.769 -3.048 . . . . 0.0 102.769 -176.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -60.32 153.96 21.37 Favored 'General case' 0 C--N 1.381 1.955 0 C-N-CA 125.133 1.373 . . . . 0.0 113.347 171.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -41.89 -21.27 0.02 OUTLIER 'General case' 0 C--N 1.366 1.292 0 N-CA-C 120.904 3.668 . . . . 0.0 120.904 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.45 64.56 Favored 'General case' 0 C--N 1.35 0.592 1 C-N-CA 133.633 4.773 . . . . 0.0 112.501 175.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.47 -32.91 52.14 Favored 'General case' 0 C--N 1.372 1.549 0 C-N-CA 130.617 3.567 . . . . 0.0 113.701 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.73 -37.4 67.77 Favored 'General case' 0 C--N 1.373 1.594 0 C-N-CA 124.956 1.302 . . . . 0.0 112.389 171.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -72.26 -37.27 69.13 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 125.404 1.481 . . . . 0.0 111.799 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . 0.501 0.0 OUTLIER -71.54 -50.35 32.04 Favored 'General case' 0 C--N 1.383 2.064 0 CA-C-N 121.1 1.773 . . . . 0.0 113.485 171.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.694 HG22 HG12 ' A' ' 92' ' ' VAL 0.414 28.6 p -57.13 -40.63 77.53 Favored 'General case' 0 C--N 1.359 1.004 0 CA-C-O 114.25 -2.786 . . . . 0.0 116.844 175.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -54.48 -35.56 63.2 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 124.478 3.308 . . . . 0.0 119.382 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 80.2 mtp -51.16 -44.66 61.5 Favored 'General case' 0 C--N 1.382 1.995 0 C-N-CA 131.194 3.798 . . . . 0.0 110.073 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.516 ' CG1' HG22 ' A' ' 92' ' ' VAL 0.668 1.5 t -73.43 -54.68 3.95 Favored Pre-proline 0 C--O 1.207 -1.134 1 CA-C-O 107.131 -6.176 . . . . 0.0 115.639 175.725 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -53.35 -16.97 8.02 Favored 'Trans proline' 0 C--N 1.383 2.359 2 CA-C-N 140.973 8.526 . . . . 0.0 116.473 168.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 22.3 mt -63.41 -47.31 82.5 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-N 121.824 2.102 . . . . 0.0 113.518 160.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.41 -53.99 14.23 Favored 'General case' 0 C--N 1.374 1.648 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 169.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . 0.34 9.5 p -66.46 -29.04 45.27 Favored 'Isoleucine or valine' 0 C--N 1.365 1.274 0 O-C-N 117.97 -2.957 . . . . 0.0 113.905 177.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.42 0.0 OUTLIER -77.01 -43.07 36.09 Favored 'General case' 0 CA--C 1.565 1.548 0 O-C-N 119.057 -2.277 . . . . 0.0 110.249 172.059 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -54.37 43.94 Favored 'General case' 0 C--N 1.392 2.446 0 C-N-CA 125.898 1.679 . . . . 0.0 115.511 171.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.69 -36.24 73.2 Favored 'General case' 0 C--N 1.36 1.047 1 C-N-CA 131.888 4.075 . . . . 0.0 115.477 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -75.29 -28.09 59.61 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -53.7 -25.06 16.7 Favored 'General case' 0 C--N 1.387 2.207 0 C-N-CA 128.393 2.677 . . . . 0.0 113.983 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -56.35 -29.85 61.9 Favored 'General case' 0 C--N 1.356 0.853 1 C-N-CA 133.731 4.812 . . . . 0.0 115.293 170.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 30.6 m -96.59 6.9 47.78 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -173.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.27 28.8 m80 81.26 51.55 0.02 OUTLIER 'General case' 0 C--N 1.353 0.759 0 C-N-CA 128.301 2.64 . . . . 0.0 114.83 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.31 152.42 19.97 Favored Pre-proline 0 CA--C 1.51 -0.561 0 O-C-N 119.06 -2.275 . . . . 0.0 105.905 172.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -88.27 5.78 5.14 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.709 2.939 . . . . 0.0 110.269 169.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.402 0.0 OUTLIER 66.52 16.03 10.29 Favored 'General case' 0 C--N 1.38 1.929 0 C-N-CA 128.768 2.827 . . . . 0.0 114.45 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mt -104.22 142.73 17.13 Favored 'Isoleucine or valine' 0 C--N 1.357 0.907 0 C-N-CA 130.029 3.332 . . . . 0.0 109.439 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -99.32 -157.52 0.61 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 126.541 1.936 . . . . 0.0 108.715 174.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -53.87 -61.03 2.57 Favored 'General case' 0 C--N 1.374 1.659 0 O-C-N 118.051 -2.906 . . . . 0.0 115.535 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -117.63 12.58 14.06 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.557 -1.339 . . . . 0.0 107.928 158.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.27 71.42 2.65 Favored Glycine 0 CA--C 1.479 -2.164 0 C-N-CA 125.623 1.582 . . . . 0.0 111.928 -173.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -50.56 144.5 7.81 Favored 'General case' 0 C--N 1.362 1.145 1 C-N-CA 132.038 4.135 . . . . 0.0 111.767 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . 0.31 1.0 OUTLIER -36.24 140.04 0.14 Allowed 'General case' 0 C--N 1.359 0.997 1 N-CA-C 122.898 4.407 . . . . 0.0 122.898 -155.547 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -133.85 158.69 42.75 Favored 'General case' 0 C--N 1.354 0.797 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -157.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.2 mp -129.02 96.59 28.55 Favored Pre-proline 0 C--N 1.376 1.735 0 C-N-CA 128.48 2.712 . . . . 0.0 108.241 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.91 162.72 38.52 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 125.087 3.858 . . . . 0.0 113.779 174.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -48.27 -41.23 27.26 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 120.735 3.605 . . . . 0.0 120.735 -170.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.49 -35.37 55.98 Favored Glycine 0 N--CA 1.499 2.846 0 C-N-CA 124.855 1.216 . . . . 0.0 114.179 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.44 0.4 OUTLIER -77.62 -22.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 O-C-N 119.669 -2.077 . . . . 0.0 112.542 175.14 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -70.39 -35.44 73.48 Favored 'General case' 0 C--N 1.373 1.597 0 C-N-CA 128.254 2.621 . . . . 0.0 112.161 169.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.355 0.1 OUTLIER -64.67 -37.58 80.46 Favored 'Isoleucine or valine' 0 C--N 1.385 2.148 0 O-C-N 121.201 -0.937 . . . . 0.0 111.086 168.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 129' ' ' LEU . 26.8 t80 -57.84 -58.55 7.89 Favored 'General case' 0 C--N 1.38 1.931 0 C-N-CA 124.807 1.243 . . . . 0.0 111.18 167.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 57' ' ' THR . 23.9 t -52.11 -63.37 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.984 0 C-N-CA 129.158 2.983 . . . . 0.0 116.389 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.99 97.89 Favored 'General case' 0 C--N 1.359 0.991 0 N-CA-C 118.94 2.941 . . . . 0.0 118.94 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.519 0.9 OUTLIER -76.73 -32.89 58.09 Favored 'General case' 0 C--N 1.379 1.876 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 176.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -46.24 89.96 Favored 'General case' 0 C--N 1.372 1.568 0 CA-C-O 124.431 2.063 . . . . 0.0 113.673 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.62 -31.71 59.99 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 111.597 -2.547 . . . . 0.0 113.683 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.9 60.43 Favored 'General case' 0 C--N 1.382 2.003 0 CA-C-N 119.737 1.153 . . . . 0.0 111.507 173.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.442 ' CG ' ' HG3' ' A' ' 122' ' ' PRO . 4.9 t80 -72.46 -54.6 8.85 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 124.172 0.989 . . . . 0.0 111.426 173.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.74 -43.67 68.4 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 125.676 1.591 . . . . 0.0 114.53 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.422 ' O ' HD21 ' A' ' 105' ' ' LEU . 53.2 tpp -49.13 -28.74 4.55 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 128.199 2.599 . . . . 0.0 117.862 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.6 t -87.51 -5.09 58.94 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.457 1.503 . . . . 0.0 113.988 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -161.34 55.44 0.28 Allowed 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 -176.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -101.78 -78.94 0.52 Allowed 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.371 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -161.64 35.91 0.38 Allowed Glycine 0 C--N 1.352 1.468 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.545 HD23 ' H ' ' A' ' 106' ' ' THR . 0.9 OUTLIER -116.4 -66.4 1.09 Allowed 'General case' 0 C--N 1.348 0.514 0 C-N-CA 125.505 1.522 . . . . 0.0 107.461 177.797 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.545 ' H ' HD23 ' A' ' 105' ' ' LEU . 11.7 t -108.5 18.41 20.97 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 127.844 2.458 . . . . 0.0 108.722 175.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.66 -5.49 81.59 Favored Glycine 0 C--N 1.366 2.247 0 C-N-CA 127.223 2.344 . . . . 0.0 115.601 -179.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 171.6 -93.22 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 101.591 -3.485 . . . . 0.0 101.591 -176.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.3 t -176.8 53.01 0.01 OUTLIER 'General case' 0 C--N 1.348 0.524 0 N-CA-C 102.857 -3.016 . . . . 0.0 102.857 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . 0.314 55.1 mtp 82.78 87.35 0.03 OUTLIER 'General case' 0 C--N 1.358 0.969 0 C-N-CA 127.99 2.516 . . . . 0.0 113.499 -176.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -73.68 -41.53 62.53 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.226 2.61 . . . . 0.0 111.113 176.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.8 t -161.9 168.89 22.19 Favored 'General case' 0 N--CA 1.437 -1.096 1 N-CA-C 99.607 -4.22 . . . . 0.0 99.607 178.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.1 p -155.25 -43.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.895 0 CA-C-N 119.664 1.12 . . . . 0.0 110.647 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 p -90.24 60.46 4.77 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 126.836 2.055 . . . . 0.0 107.315 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.27 159.68 15.5 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 128.851 2.861 . . . . 0.0 116.582 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -126.7 136.19 52.13 Favored 'General case' 0 C--N 1.356 0.85 0 CA-C-O 123.224 1.488 . . . . 0.0 108.76 175.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HD1' HD11 ' A' ' 121' ' ' ILE . 21.0 m-85 -75.97 -6.02 49.01 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 130.348 3.459 . . . . 0.0 116.374 -168.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.6 55.18 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.247 2.219 . . . . 0.0 109.727 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 t -123.97 23.07 8.67 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.154 2.181 . . . . 0.0 107.766 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -151.95 -172.57 4.26 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 126.388 1.875 . . . . 0.0 109.054 175.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.409 HD11 ' HD1' ' A' ' 117' ' ' PHE 0.301 3.0 mm 72.72 137.87 0.06 OUTLIER Pre-proline 0 C--N 1.377 1.773 0 C-N-CA 129.796 3.239 . . . . 0.0 114.955 173.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.442 ' HG3' ' CG ' ' A' ' 98' ' ' PHE . 36.3 Cg_endo -63.93 148.5 91.68 Favored 'Trans proline' 0 C--N 1.368 1.602 0 CA-C-N 128.258 3.985 . . . . 0.0 119.911 -170.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.2 m -65.88 -20.32 66.18 Favored 'General case' 0 C--N 1.371 1.538 0 C-N-CA 130.288 3.435 . . . . 0.0 115.838 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -78.98 -47.01 17.07 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.834 1.653 . . . . 0.0 111.969 177.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.457 HG22 ' HD1' ' A' ' 91' ' ' PHE 0.374 4.3 mp -70.59 -28.57 35.02 Favored 'Isoleucine or valine' 0 C--N 1.371 1.501 0 O-C-N 119.67 -1.894 . . . . 0.0 112.23 176.516 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 53.0 mt -51.24 -27.14 8.36 Favored 'General case' 0 C--N 1.37 1.499 0 O-C-N 117.869 -3.019 . . . . 0.0 115.088 169.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -74.93 -19.59 60.06 Favored 'General case' 0 C--N 1.365 1.282 0 C-N-CA 130.43 3.492 . . . . 0.0 112.264 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -84.33 -25.98 28.81 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.294 2.237 . . . . 0.0 112.368 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.465 ' HB2' ' CD2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -71.34 1.04 6.75 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 127.391 2.276 . . . . 0.0 111.843 168.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . 0.27 5.2 m-80 -96.88 -55.41 0.2 Allowed Pre-proline 0 CA--C 1.56 1.342 0 C-N-CA 130.221 3.408 . . . . 0.0 117.475 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.4 -7.51 17.89 Favored 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 127.149 5.232 . . . . 0.0 117.677 177.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -161.74 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.138 1 N-CA-C 123.062 4.467 . . . . 0.0 123.062 -178.416 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 116.12 15.52 Favored 'General case' 0 CA--C 1.555 1.157 0 O-C-N 119.416 -2.052 . . . . 0.0 112.934 177.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . 0.42 14.3 mmmm 102.25 -9.3 0.03 OUTLIER 'General case' 0 C--N 1.377 1.774 0 C-N-CA 128.896 2.878 . . . . 0.0 113.604 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 2.3 mmm -110.74 27.66 9.44 Favored 'General case' 0 C--N 1.361 1.103 0 O-C-N 120.209 -1.557 . . . . 0.0 111.647 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -84.87 42.69 0.94 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.977 2.511 . . . . 0.0 113.516 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 . . . . . 0 C--N 1.354 0.789 0 C-N-CA 125.807 1.643 . . . . 0.0 107.866 179.918 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 . . . . . 0 N--CA 1.44 -0.956 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -133.41 45.32 2.7 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 125.688 1.595 . . . . 0.0 108.941 -177.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.7 p -54.8 -41.45 57.0 Favored 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 130.807 3.643 . . . . 0.0 116.418 -176.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . 0.38 0.0 OUTLIER -67.01 -27.32 67.32 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 127.579 2.352 . . . . 0.0 114.729 174.509 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -59.04 -24.85 63.21 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 52.9 tp -77.2 -50.94 11.82 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 120.422 -1.424 . . . . 0.0 113.018 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.49 -16.15 49.82 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.574 2.349 . . . . 0.0 115.502 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.4 m -71.76 -9.95 59.05 Favored 'General case' 0 C--N 1.375 1.717 0 C-N-CA 125.855 1.662 . . . . 0.0 112.837 176.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 52' ' ' HIS . 5.8 pt -139.55 -58.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 127.266 2.226 . . . . 0.0 111.329 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 38.4 m -90.78 74.39 6.58 Favored 'General case' 0 C--N 1.357 0.931 0 C-N-CA 126.449 1.9 . . . . 0.0 107.451 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 159.5 -57.87 0.0 OUTLIER 'General case' 0 C--N 1.352 0.7 0 C-N-CA 129.696 3.198 . . . . 0.0 103.749 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.4 -140.99 0.0 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 169.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -87.26 -27.36 22.97 Favored 'General case' 0 C--N 1.362 1.122 0 O-C-N 117.336 -3.353 . . . . 0.0 118.088 -167.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.45 ' HB2' HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -81.29 -2.94 50.91 Favored 'General case' 0 C--N 1.348 0.532 0 C-N-CA 126.987 2.115 . . . . 0.0 114.174 -173.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.28 -41.3 75.67 Favored 'General case' 0 C--N 1.372 1.558 0 C-N-CA 131.305 3.842 . . . . 0.0 111.498 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -72.09 -46.49 56.54 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 128.443 2.697 . . . . 0.0 112.84 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.98 -49.14 71.46 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.09 2.556 . . . . 0.0 114.202 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.424 0.0 OUTLIER -71.86 -38.42 70.07 Favored 'General case' 0 C--N 1.373 1.614 0 C-N-CA 124.508 1.123 . . . . 0.0 113.786 175.448 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.431 HG22 HG23 ' A' ' 92' ' ' VAL 0.447 68.2 p -60.28 -53.15 61.1 Favored 'General case' 0 C--N 1.368 1.374 0 CA-C-O 114.182 -2.818 . . . . 0.0 116.286 174.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -57.34 -23.09 46.64 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 123.586 2.903 . . . . 0.0 118.622 177.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -43.23 87.1 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 130.939 3.696 . . . . 0.0 112.402 169.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.605 ' CG1' HG12 ' A' ' 92' ' ' VAL 0.412 3.9 t -71.33 -50.65 10.78 Favored Pre-proline 0 C--O 1.208 -1.129 1 CA-C-O 109.795 -4.907 . . . . 0.0 113.079 173.212 . . . . . . . . 4 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 31.7 Cg_exo -50.69 -23.67 11.65 Favored 'Trans proline' 0 C--N 1.374 1.873 2 CA-C-N 135.188 6.46 . . . . 0.0 116.021 164.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -59.51 -52.62 64.81 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 122.884 2.584 . . . . 0.0 112.91 162.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.503 HD22 HG13 ' A' ' 121' ' ' ILE . 15.2 tp -61.99 -54.07 46.8 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 119.319 3.081 . . . . 0.0 119.319 167.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 61' ' ' PRO 0.303 0.4 OUTLIER -69.8 -29.73 41.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.747 0 C-N-CA 130.081 3.352 . . . . 0.0 113.47 -177.962 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.408 12.6 tt0 -77.49 -41.17 40.44 Favored 'General case' 0 C--N 1.379 1.859 0 O-C-N 120.744 -1.223 . . . . 0.0 109.362 174.42 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.63 -55.26 37.09 Favored 'General case' 0 C--N 1.393 2.496 0 C-N-CA 125.814 1.645 . . . . 0.0 114.25 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.42 -39.03 71.35 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 129.408 3.083 . . . . 0.0 115.851 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . 0.453 34.5 tptt -75.89 -22.34 56.23 Favored 'General case' 0 C--N 1.369 1.431 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 178.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.11 -22.81 6.72 Favored 'General case' 0 C--N 1.375 1.71 0 O-C-N 118.612 -2.555 . . . . 0.0 114.824 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.264 4.3 tm-20 -58.86 -23.17 60.45 Favored 'General case' 0 C--N 1.357 0.935 1 C-N-CA 136.138 5.775 . . . . 0.0 114.204 168.881 . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 32.6 t -71.17 -29.23 64.93 Favored 'General case' 0 C--N 1.373 1.599 0 C-N-CA 129.23 3.012 . . . . 0.0 117.47 -175.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 32.6 m80 124.19 -4.6 0.0 OUTLIER 'General case' 0 C--N 1.354 0.768 0 C-N-CA 128.272 2.629 . . . . 0.0 108.882 -172.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.03 167.13 14.85 Favored Pre-proline 0 C--N 1.365 1.26 0 O-C-N 120.273 -1.517 . . . . 0.0 114.679 -167.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -97.57 -5.64 1.07 Allowed 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.777 2.985 . . . . 0.0 114.581 177.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . 0.453 0.7 OUTLIER 39.71 63.08 1.08 Allowed 'General case' 0 C--N 1.387 2.216 0 C-N-CA 129.76 3.224 . . . . 0.0 116.779 -177.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 57.2 mt -111.53 146.43 16.49 Favored 'Isoleucine or valine' 0 C--N 1.358 0.967 0 C-N-CA 128.044 2.537 . . . . 0.0 105.871 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.06 175.6 5.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.79 -1.194 . . . . 0.0 111.113 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -49.2 -18.72 0.37 Allowed 'General case' 0 C--N 1.368 1.396 0 C-N-CA 130.302 3.441 . . . . 0.0 119.902 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -105.25 1.41 28.09 Favored 'General case' 0 C--N 1.363 1.172 0 C-N-CA 125.279 1.432 . . . . 0.0 109.594 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.89 31.55 59.96 Favored Glycine 0 C--N 1.363 2.063 0 C-N-CA 130.207 3.765 . . . . 0.0 115.769 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -112.42 171.31 7.59 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 126.631 1.973 . . . . 0.0 106.608 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 151.74 46.28 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -177.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.1 t -124.25 121.33 34.74 Favored 'General case' 0 C--N 1.364 1.215 0 O-C-N 120.434 -1.416 . . . . 0.0 113.164 -174.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 13.1 mt -133.41 136.17 26.6 Favored Pre-proline 0 C--N 1.37 1.49 0 O-C-N 119.158 -2.214 . . . . 0.0 107.142 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.452 ' HG2' HG23 ' A' ' 88' ' ' VAL . 81.2 Cg_endo -83.32 -179.44 4.31 Favored 'Trans proline' 0 C--N 1.366 1.457 1 C-N-CA 127.163 5.242 . . . . 0.0 111.097 172.652 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.5 m -51.66 -49.12 62.95 Favored 'General case' 0 C--N 1.363 1.188 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.54 -38.52 43.97 Favored Glycine 0 N--CA 1.499 2.85 0 CA-C-O 123.53 1.628 . . . . 0.0 114.456 -176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.603 HG11 ' CG ' ' A' ' 132' ' ' TYR 0.281 0.3 OUTLIER -73.31 -24.44 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 127.604 2.361 . . . . 0.0 112.204 179.716 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.0 -46.69 61.79 Favored 'General case' 0 C--N 1.375 1.677 0 C-N-CA 129.307 3.043 . . . . 0.0 111.162 170.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.399 31.0 pt -62.79 -28.4 44.87 Favored 'Isoleucine or valine' 0 C--N 1.377 1.789 0 O-C-N 120.481 -1.387 . . . . 0.0 113.23 175.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -61.9 -58.51 7.64 Favored 'General case' 0 C--N 1.381 1.97 0 C-N-CA 127.236 2.215 . . . . 0.0 111.097 164.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.605 HG12 ' CG1' ' A' ' 60' ' ' VAL 0.368 9.5 m -50.89 -52.55 16.92 Favored 'Isoleucine or valine' 0 C--N 1.378 1.843 0 CA-C-N 121.508 1.958 . . . . 0.0 116.147 -176.595 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.5 -51.35 67.79 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.465 8.1 ptpp? -75.1 -28.68 60.35 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 122.415 2.37 . . . . 0.0 115.51 -178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.64 -53.91 51.71 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 128.284 2.633 . . . . 0.0 113.234 173.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -78.39 -32.63 48.9 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -25.75 63.53 Favored 'General case' 0 C--N 1.374 1.673 0 CA-C-N 119.725 1.148 . . . . 0.0 112.931 173.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.94 -56.95 4.32 Favored 'General case' 0 C--N 1.361 1.065 0 C-N-CA 125.178 1.391 . . . . 0.0 112.846 172.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.563 ' CE1' HG23 ' A' ' 121' ' ' ILE 0.54 1.0 OUTLIER -72.61 -50.88 22.28 Favored 'General case' 0 C--N 1.377 1.776 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 177.981 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.69 -28.45 68.45 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 127.045 2.138 . . . . 0.0 114.015 -168.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.7 m -72.11 -4.24 27.85 Favored 'General case' 0 C--N 1.358 0.97 0 C-N-CA 127.672 2.389 . . . . 0.0 113.842 176.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.21 -9.8 55.86 Favored 'General case' 0 C--N 1.371 1.516 0 O-C-N 119.784 -1.822 . . . . 0.0 109.213 169.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.6 35.62 0.83 Allowed 'General case' 0 C--N 1.361 1.108 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -86.1 -24.05 42.46 Favored Glycine 0 C--N 1.352 1.438 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 162.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.301 2.3 pt? -118.53 -57.82 2.03 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 117.629 2.455 . . . . 0.0 117.629 -177.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.3 t -97.61 37.2 1.4 Allowed 'General case' 0 C--N 1.363 1.177 0 C-N-CA 127.979 2.512 . . . . 0.0 106.782 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.81 178.41 53.68 Favored Glycine 0 C--N 1.351 1.397 1 C-N-CA 132.059 4.647 . . . . 0.0 113.694 -178.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.7 ttp85 144.03 -29.94 0.01 OUTLIER 'General case' 0 C--N 1.368 1.402 0 N-CA-C 101.092 -3.67 . . . . 0.0 101.092 -173.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 m -45.93 76.49 0.0 OUTLIER 'General case' 0 C--N 1.371 1.529 1 C-N-CA 134.488 5.115 . . . . 0.0 116.688 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 40.6 ttp -106.28 177.7 4.78 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.853 1.661 . . . . 0.0 107.462 178.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -76.26 68.4 2.65 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 119.278 -2.139 . . . . 0.0 112.757 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.319 76.8 p 94.0 130.79 0.02 OUTLIER 'General case' 0 C--N 1.363 1.176 0 C-N-CA 131.448 3.899 . . . . 0.0 108.155 -171.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.7 p -158.79 37.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.126 0 CA-C-O 124.797 2.237 . . . . 0.0 106.477 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . 0.261 8.5 t 98.03 -31.06 0.02 OUTLIER 'General case' 0 C--N 1.357 0.933 0 C-N-CA 130.855 3.662 . . . . 0.0 108.859 -171.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 165.77 13.87 Favored 'General case' 0 C--N 1.366 1.31 0 C-N-CA 126.593 1.957 . . . . 0.0 115.81 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -131.72 164.75 25.27 Favored 'General case' 0 C--N 1.361 1.086 0 CA-C-O 123.678 1.704 . . . . 0.0 112.287 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -77.01 -6.08 51.23 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 130.059 3.344 . . . . 0.0 113.828 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.15 -8.56 59.48 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 129.721 3.208 . . . . 0.0 111.036 171.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 p -107.5 -29.0 9.46 Favored 'General case' 0 C--N 1.364 1.235 0 C-N-CA 127.648 2.379 . . . . 0.0 112.911 -176.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -115.16 -141.78 0.38 Allowed 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.217 1.407 . . . . 0.0 114.136 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.797 HG22 ' HD2' ' A' ' 122' ' ' PRO 0.351 0.0 OUTLIER 72.32 160.0 0.16 Allowed Pre-proline 0 C--N 1.381 1.938 1 C-N-CA 132.344 4.258 . . . . 0.0 115.176 175.664 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.797 ' HD2' HG22 ' A' ' 121' ' ' ILE . 51.9 Cg_exo -67.14 134.74 34.94 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 124.937 3.758 . . . . 0.0 113.763 177.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 3.4 m -48.98 -43.39 40.07 Favored 'General case' 0 C--N 1.37 1.497 0 C-N-CA 129.577 3.151 . . . . 0.0 116.277 -178.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.0 m -59.14 -56.98 15.18 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 129.793 3.237 . . . . 0.0 114.738 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.437 0.0 OUTLIER -70.46 -28.12 33.86 Favored 'Isoleucine or valine' 0 C--N 1.367 1.363 0 O-C-N 120.191 -1.568 . . . . 0.0 114.708 -177.715 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.11 -26.91 29.86 Favored 'General case' 0 C--N 1.375 1.702 0 O-C-N 118.428 -2.67 . . . . 0.0 114.27 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -73.06 -23.57 60.58 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.687 2.395 . . . . 0.0 112.704 170.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -14.83 49.75 Favored 'General case' 0 C--N 1.374 1.636 0 C-N-CA 128.515 2.726 . . . . 0.0 113.505 174.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -35.75 72.35 Favored 'General case' 0 N--CA 1.514 2.751 0 C-N-CA 125.361 1.464 . . . . 0.0 113.726 164.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -77.75 -47.33 2.34 Favored Pre-proline 0 CA--C 1.559 1.327 0 N-CA-C 118.31 2.707 . . . . 0.0 118.31 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.09 -5.32 0.14 Allowed 'Trans proline' 0 C--N 1.374 1.887 1 C-N-CA 130.589 7.526 . . . . 0.0 117.512 171.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.603 ' CG ' HG11 ' A' ' 88' ' ' VAL . 1.5 t80 -63.06 -162.92 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.996 1 C-N-CA 133.168 4.587 . . . . 0.0 115.757 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -7.52 -47.85 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.159 1 C-N-CA 134.716 5.206 . . . . 0.0 121.395 -179.963 . . . . . . . . 4 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? -65.33 -4.9 6.07 Favored 'General case' 0 C--N 1.374 1.639 0 C-N-CA 127.994 2.517 . . . . 0.0 114.857 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 -24.69 41.83 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 129.172 2.989 . . . . 0.0 111.718 170.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . 66.96 -47.28 0.47 Allowed 'General case' 0 C--N 1.369 1.421 0 C-N-CA 129.567 3.147 . . . . 0.0 117.512 177.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 . . . . . 0 C--N 1.358 0.966 0 C-N-CA 129.943 3.297 . . . . 0.0 113.467 -179.334 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -119.5 146.51 45.38 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 105.739 176.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.65 -40.65 51.83 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 128.996 2.919 . . . . 0.0 114.415 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -28.39 67.18 Favored 'General case' 0 C--N 1.365 1.243 0 C-N-CA 128.403 2.681 . . . . 0.0 113.572 175.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -57.98 -25.82 61.54 Favored 'General case' 0 C--N 1.369 1.43 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.22 -49.56 16.82 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.609 -1.932 . . . . 0.0 113.759 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -17.69 41.25 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.518 1.927 . . . . 0.0 114.333 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -70.19 -14.78 62.78 Favored 'General case' 0 C--N 1.376 1.734 0 C-N-CA 127.573 2.349 . . . . 0.0 111.98 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.2 pt -127.85 -63.32 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.733 0 C-N-CA 124.386 1.074 . . . . 0.0 113.532 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.3 t -96.6 68.64 2.49 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 120.187 -1.571 . . . . 0.0 109.481 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 176.39 -64.44 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 102.224 -3.25 . . . . 0.0 102.224 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.58 -149.58 0.01 OUTLIER 'General case' 0 C--N 1.381 1.965 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 167.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -66.56 -4.65 9.02 Favored 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -167.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -112.97 14.27 19.65 Favored 'General case' 0 C--N 1.353 0.742 0 O-C-N 118.882 -2.386 . . . . 0.0 113.821 -170.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.86 -41.28 97.82 Favored 'General case' 0 C--N 1.375 1.713 0 C-N-CA 128.509 2.724 . . . . 0.0 111.387 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -72.68 -46.25 54.74 Favored 'General case' 0 C--N 1.363 1.168 0 C-N-CA 126.031 1.733 . . . . 0.0 113.575 169.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -65.79 -43.14 89.65 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' HB2' ' HB1' ' A' ' 96' ' ' ALA 0.413 0.3 OUTLIER -69.26 -43.02 74.8 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 119.551 1.069 . . . . 0.0 112.828 173.339 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.4 ' O ' ' HD3' ' A' ' 61' ' ' PRO 0.503 68.3 p -64.21 -34.41 78.03 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-O 113.905 -2.95 . . . . 0.0 117.022 176.648 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.59 -37.39 87.16 Favored 'General case' 0 C--N 1.374 1.642 0 CA-C-N 123.71 2.959 . . . . 0.0 117.51 176.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.508 ' HE3' ' CE2' ' A' ' 99' ' ' TYR 0.253 45.9 mtp -49.41 -43.81 44.8 Favored 'General case' 0 C--N 1.384 2.075 0 C-N-CA 131.257 3.823 . . . . 0.0 111.309 172.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 92' ' ' VAL 0.611 2.1 t -74.38 -52.06 4.14 Favored Pre-proline 0 N--CA 1.436 -1.127 1 CA-C-O 107.769 -5.872 . . . . 0.0 115.512 179.032 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 49.0 Cg_exo -53.73 -18.56 12.52 Favored 'Trans proline' 0 C--N 1.392 2.846 2 CA-C-N 139.412 7.968 . . . . 0.0 115.284 164.006 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.9 -47.45 84.94 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 122.516 2.416 . . . . 0.0 113.097 160.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.1 tp -68.85 -53.97 18.34 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 117.973 2.583 . . . . 0.0 117.973 169.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG1' HG12 ' A' ' 60' ' ' VAL 0.427 1.9 m -71.05 -30.54 41.62 Favored 'Isoleucine or valine' 0 C--N 1.366 1.295 0 O-C-N 117.173 -3.454 . . . . 0.0 114.666 178.285 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 61' ' ' PRO 0.508 14.7 tt0 -71.61 -41.76 68.49 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 121.891 2.132 . . . . 0.0 110.422 173.74 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -53.07 61.93 Favored 'General case' 0 C--N 1.389 2.314 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 168.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.67 -39.17 73.7 Favored 'General case' 0 C--N 1.358 0.947 0 C-N-CA 128.742 2.817 . . . . 0.0 118.099 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.556 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 0.1 OUTLIER -74.05 -30.5 62.44 Favored 'General case' 0 C--N 1.372 1.572 0 C-N-CA 125.795 1.638 . . . . 0.0 110.88 175.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.94 -23.0 11.51 Favored 'General case' 0 C--N 1.389 2.294 0 C-N-CA 127.549 2.34 . . . . 0.0 114.75 177.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -63.09 -26.65 68.93 Favored 'General case' 0 C--N 1.36 1.041 1 C-N-CA 132.293 4.237 . . . . 0.0 113.413 172.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 81.1 m -97.63 21.19 10.67 Favored 'General case' 0 C--N 1.365 1.276 0 N-CA-C 116.71 2.115 . . . . 0.0 116.71 -172.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 101.25 -13.48 0.03 OUTLIER 'General case' 0 C--N 1.36 1.048 0 N-CA-C 118.014 2.598 . . . . 0.0 118.014 169.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -136.74 157.18 75.46 Favored Pre-proline 0 C--N 1.344 0.367 0 O-C-N 120.067 -1.646 . . . . 0.0 112.567 -168.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -88.59 -7.08 5.77 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 123.423 2.748 . . . . 0.0 114.386 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 68' ' ' LYS 0.34 1.8 p90 39.65 43.53 1.11 Allowed 'General case' 0 C--N 1.389 2.321 0 C-N-CA 129.487 3.115 . . . . 0.0 115.459 -178.387 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 tt -158.91 162.93 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.565 0 N-CA-C 101.171 -3.64 . . . . 0.0 101.171 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -106.37 -158.22 0.65 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.341 1.428 . . . . 0.0 108.546 173.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -52.95 -60.5 3.2 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.96 2.104 . . . . 0.0 115.796 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -116.8 6.58 13.21 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 160.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -73.04 81.25 0.68 Allowed Glycine 0 C--N 1.357 1.725 0 C-N-CA 126.403 1.954 . . . . 0.0 113.59 -171.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.65 134.0 12.98 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 133.751 4.82 . . . . 0.0 114.245 -170.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -35.56 149.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 2 N-CA-C 123.122 4.49 . . . . 0.0 123.122 -152.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.1 t -120.85 125.76 48.33 Favored 'General case' 0 C--N 1.371 1.525 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 -166.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 3.9 mt -126.42 119.09 23.17 Favored Pre-proline 0 C--N 1.374 1.649 0 O-C-N 120.239 -1.538 . . . . 0.0 113.143 -174.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -80.06 170.97 15.83 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 124.513 3.475 . . . . 0.0 111.876 166.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.7 m -49.11 -40.07 30.78 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 131.141 3.776 . . . . 0.0 120.208 -176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.12 -45.48 31.52 Favored Glycine 0 N--CA 1.497 2.715 0 O-C-N 120.471 -1.393 . . . . 0.0 112.924 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . 0.417 0.4 OUTLIER -67.0 -23.14 30.36 Favored 'Isoleucine or valine' 0 C--N 1.373 1.619 0 O-C-N 120.475 -1.603 . . . . 0.0 113.697 175.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.522 ' HA ' HG22 ' A' ' 92' ' ' VAL . 9.6 tp -70.47 -42.34 71.55 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 130.236 3.414 . . . . 0.0 112.66 173.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -32.5 56.27 Favored 'Isoleucine or valine' 0 C--N 1.385 2.138 0 O-C-N 120.884 -1.135 . . . . 0.0 111.954 169.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE2' ' HB2' ' A' ' 129' ' ' LEU 0.263 59.1 t80 -67.48 -55.65 12.73 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-O 116.174 -1.869 . . . . 0.0 110.574 175.09 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.538 ' HA ' HG11 ' A' ' 60' ' ' VAL 0.324 33.5 m -50.76 -56.56 4.13 Favored 'Isoleucine or valine' 0 C--N 1.379 1.848 0 CA-C-N 122.055 2.207 . . . . 0.0 115.357 178.303 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.36 -51.4 66.07 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 116.817 2.155 . . . . 0.0 116.817 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . 0.431 61.7 mmtt -75.51 -28.5 59.15 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 121.598 1.999 . . . . 0.0 115.979 -177.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.58 -57.92 10.83 Favored 'General case' 0 C--N 1.382 1.99 0 C-N-CA 127.398 2.279 . . . . 0.0 110.211 170.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.486 ' HB1' ' HB2' ' A' ' 56' ' ' LEU . . . -68.38 -35.32 77.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.74 -23.45 63.39 Favored 'General case' 0 C--N 1.376 1.738 0 CA-C-N 120.697 1.59 . . . . 0.0 112.074 170.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -74.64 -57.26 4.04 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 171.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.508 ' CE2' ' HE3' ' A' ' 59' ' ' MET 0.522 35.8 p90 -72.62 -32.72 66.14 Favored 'General case' 0 C--N 1.37 1.476 0 N-CA-C 118.982 2.956 . . . . 0.0 118.982 -179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.8 ptm -67.2 -28.42 68.07 Favored 'General case' 0 C--N 1.37 1.475 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -171.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 6.5 t -83.52 -7.23 59.57 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 128.14 2.576 . . . . 0.0 112.917 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -104.68 -54.42 2.51 Favored 'General case' 0 C--N 1.364 1.202 0 C-N-CA 130.346 3.458 . . . . 0.0 109.042 174.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.96 8.4 23.38 Favored 'General case' 0 C--N 1.377 1.783 0 O-C-N 119.849 -1.782 . . . . 0.0 115.703 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -82.98 -22.09 58.16 Favored Glycine 0 C--N 1.347 1.155 0 C-N-CA 126.693 2.092 . . . . 0.0 110.083 161.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.477 1.6 pt? -120.64 -53.08 2.11 Favored 'General case' 0 C--N 1.369 1.455 0 N-CA-C 121.354 3.835 . . . . 0.0 121.354 175.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -118.1 37.9 3.85 Favored 'General case' 0 CA--C 1.487 -1.448 0 C-N-CA 127.599 2.36 . . . . 0.0 106.807 -168.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.19 23.3 6.23 Favored Glycine 0 N--CA 1.432 -1.578 0 C-N-CA 127.329 2.395 . . . . 0.0 118.894 -167.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.5 mtm-85 65.64 -58.72 0.3 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 128.623 2.769 . . . . 0.0 117.9 170.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.0 t -88.58 -51.66 5.57 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 127.732 2.413 . . . . 0.0 108.543 173.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . 0.405 ' HG2' ' H ' ' A' ' 111' ' ' ASP . 4.7 ttt -164.82 -179.27 5.72 Favored 'General case' 0 C--N 1.362 1.126 0 CA-C-O 121.635 0.731 . . . . 0.0 109.062 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' HG2' ' A' ' 110' ' ' MET . 0.3 OUTLIER -97.21 89.28 4.71 Favored 'General case' 0 C--N 1.352 0.699 0 C-N-CA 130.599 3.559 . . . . 0.0 112.13 -179.167 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . 0.38 2.4 t 65.54 32.19 9.54 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 129.414 3.086 . . . . 0.0 117.209 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 91.3 t -127.75 -75.33 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.366 0 O-C-N 119.393 -2.067 . . . . 0.0 107.729 -176.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 12.6 p -88.27 35.41 0.76 Allowed 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.633 2.373 . . . . 0.0 110.739 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -81.02 61.72 4.71 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.806 2.042 . . . . 0.0 112.457 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -67.94 100.23 0.94 Allowed 'General case' 0 C--N 1.364 1.232 0 N-CA-C 117.164 2.283 . . . . 0.0 117.164 -174.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.75 -34.0 0.23 Allowed 'General case' 0 C--N 1.344 0.344 1 C-N-CA 138.811 6.844 . . . . 0.0 118.316 179.54 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -86.34 -8.79 57.42 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 127.47 2.308 . . . . 0.0 112.091 176.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.3 p -111.67 -41.0 4.16 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 128.159 2.583 . . . . 0.0 110.416 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.29 84.88 2.11 Favored 'General case' 0 C--N 1.373 1.614 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -173.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.679 ' HB ' ' HD2' ' A' ' 122' ' ' PRO . 1.4 pt -145.42 171.11 6.93 Favored Pre-proline 0 C--N 1.372 1.582 0 O-C-N 118.257 -2.777 . . . . 0.0 109.428 173.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.679 ' HD2' ' HB ' ' A' ' 121' ' ' ILE . 31.5 Cg_endo -57.94 131.14 41.9 Favored 'Trans proline' 0 C--N 1.384 2.445 1 C-N-CA 125.568 4.179 . . . . 0.0 116.678 174.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 8.5 m -58.79 -36.24 74.11 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 128.352 2.661 . . . . 0.0 114.515 177.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 87.4 m -60.97 -57.09 14.1 Favored 'General case' 0 C--N 1.363 1.177 0 C-N-CA 129.737 3.215 . . . . 0.0 114.855 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . 0.296 0.1 OUTLIER -70.46 -28.61 35.57 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 C-N-CA 126.062 1.745 . . . . 0.0 112.852 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.86 -27.12 62.95 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 128.707 2.803 . . . . 0.0 114.773 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -75.38 -27.91 59.29 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.913 -1.742 . . . . 0.0 112.04 170.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -79.17 -14.15 59.27 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 129.95 3.3 . . . . 0.0 111.919 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . 0.4 OUTLIER -56.85 -38.19 72.33 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.381 -1.45 . . . . 0.0 112.528 166.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -88.94 -17.86 0.23 Allowed Pre-proline 0 C--N 1.356 0.852 1 N-CA-C 123.02 4.452 . . . . 0.0 123.02 -174.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -74.22 -8.87 21.42 Favored 'Trans proline' 0 C--N 1.356 0.941 1 CA-C-N 130.31 4.718 . . . . 0.0 115.305 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.556 ' CE2' ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -31.91 -103.28 0.0 OUTLIER 'General case' 0 C--N 1.368 1.409 1 C-N-CA 132.395 4.278 . . . . 0.0 120.904 178.602 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -105.24 -87.4 0.45 Allowed 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 125.19 1.396 . . . . 0.0 109.333 176.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -82.61 76.73 9.45 Favored 'General case' 0 C--N 1.353 0.738 0 O-C-N 120.205 -1.56 . . . . 0.0 112.297 -178.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.77 -46.87 28.4 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 127.692 2.397 . . . . 0.0 112.55 177.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -173.2 -174.19 1.01 Allowed 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . 0.256 10.2 mpt_? . . . . . 0 C--N 1.364 1.233 0 C-N-CA 128.356 2.662 . . . . 0.0 113.265 178.378 . . . . . . . . 1 1 . 1 stop_ save_